CAS RN: 154302-76-8
CAS Name: benzene-1,3-dicarboxylic acid; 2,2-bis(hydroxymethyl)propane-1,3-diol; 2,2-dimethylpropane-1,3-diol; hexanedioic acid; isobenzofuran-1,3-dione
OPENEYE Name: adipic acid; 2,2-bis(hydroxymethyl)propane-1,3-diol; 2,2-dimethylpropane-1,3-diol; isobenzofuran-1,3-dione; isophthalic acid
IUPAC Name: benzene-1,3-dicarboxylic acid; 2-benzofuran-1,3-dione; 2,2-bis(hydroxymethyl)propane-1,3-diol; 2,2-dimethylpropane-1,3-diol; hexanedioic acid
SYSTEMATIC NAME: benzene-1,3-dicarboxylic acid; 2-benzofuran-1,3-dione; 2,2-bis(hydroxymethyl)propane-1,3-diol; 2,2-dimethylpropane-1,3-diol; hexanedioic acid
MOLECULAR FORMULA: C32H44O17
MOLECULAR WEIGHT: 700.68156
SMILES: CC(C)(CO)CO.C1=CC=C2C(=C1)C(=O)OC2=O.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(CCC(=O)O)CC(=O)O.C(C(CO)(CO)CO)O
Structure:
CAS RN: 71010-58-7
CAS Name: benzene-1,3-dicarboxylic acid; 2,2-bis(hydroxymethyl)propane-1,3-diol; 2,2-dimethylpropane-1,3-diol; hexanedioic acid; isobenzofuran-1,3-dione
OPENEYE Name: adipic acid; 2,2-bis(hydroxymethyl)propane-1,3-diol; 2,2-dimethylpropane-1,3-diol; isobenzofuran-1,3-dione; isophthalic acid
IUPAC Name: benzene-1,3-dicarboxylic acid; 2-benzofuran-1,3-dione; 2,2-bis(hydroxymethyl)propane-1,3-diol; 2,2-dimethylpropane-1,3-diol; hexanedioic acid
SYSTEMATIC NAME: benzene-1,3-dicarboxylic acid; 2-benzofuran-1,3-dione; 2,2-bis(hydroxymethyl)propane-1,3-diol; 2,2-dimethylpropane-1,3-diol; hexanedioic acid
MOLECULAR FORMULA: C32H44O17
MOLECULAR WEIGHT: 700.68156
SMILES: CC(C)(CO)CO.C1=CC=C2C(=C1)C(=O)OC2=O.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(CCC(=O)O)CC(=O)O.C(C(CO)(CO)CO)O
Structure:
CAS RN: 71002-32-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C34H45O3P
MOLECULAR WEIGHT: 532.693061
SMILES: COP(OCC1CC2CC1C3C2C4CC3C=C4)OC(C5CC6CC5C=C6)C7CC8CC7C9C8C1CC9C=C1
Structure:
CAS RN: 71002-30-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C39H51O3P
MOLECULAR WEIGHT: 598.794201
SMILES: C1C2CC(C1COP(OCC3CC4CC3C5C4C6CC5C=C6)OCC7CC8CC7C9C8C1CC9C=C1)C1C2C2CC1C=C2
Structure:
CAS RN: 71002-27-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C29H39O3P
MOLECULAR WEIGHT: 466.591921
SMILES: C1C2CC(C1C=C2)CC(CC3CC4CC3C=C4)(C5CC6CC5C7C6C8CC7C=C8)OP(O)O
Structure:
CAS RN: 71002-22-7
CAS Name: copper tetrasodium 2-[[4-chloro-6-(4-sulfonatoanilino)-1,3,5-triazin-2-yl]amino]-5-oxido-6-(2-oxido-5-sulfonatophenyl)azonaphthalene-1,7-disulfonate
OPENEYE Name: copper tetrasodium 2-[[4-chloro-6-(4-sulfonatoanilino)-1,3,5-triazin-2-yl]amino]-5-oxido-6-(2-oxido-5-sulfonato-phenyl)azo-naphthalene-1,7-disulfonate
IUPAC Name: copper tetrasodium 2-[[4-chloro-6-(4-sulfonatoanilino)-1,3,5-triazin-2-yl]amino]-5-oxido-6-[(2-oxido-5-sulfonatophenyl)diazenyl]naphthalene-1,7-disulfonate
SYSTEMATIC NAME: copper tetrasodium 2-[[4-chloranyl-6-[(4-sulfonatophenyl)amino]-1,3,5-triazin-2-yl]amino]-5-oxidanidyl-6-[(2-oxidanidyl-5-sulfonato-phenyl)diazenyl]naphthalene-1,7-disulfonate
MOLECULAR FORMULA: C25H12ClCuN7Na4O14S4
MOLECULAR WEIGHT: 953.61936
SMILES: C1=CC(=CC=C1NC2=NC(=NC(=N2)Cl)NC3=C(C4=CC(=C(C(=C4C=C3)[O-])N=NC5=C(C=CC(=C5)S(=O)(=O)[O-])[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Cu+2]
Structure:
CAS RN: 71002-16-9
CAS Name: tetrasodium 1-[3-[[4-chloro-6-(4-sulfoanilino)-1,3,5-triazin-2-yl]amino]-2-methyl-5-sulfonatophenyl]-4-[4-[[4-chloro-6-(4-sulfonatoanilino)-1,3,5-triazin-2-yl]amino]-2-sulfonatophenyl]azo-5-oxo-4H-pyrazole-3-carboxylate
OPENEYE Name: tetrasodium 1-[3-[[4-chloro-6-(4-sulfoanilino)-1,3,5-triazin-2-yl]amino]-2-methyl-5-sulfonato-phenyl]-4-[4-[[4-chloro-6-(4-sulfonatoanilino)-1,3,5-triazin-2-yl]amino]-2-sulfonato-phenyl]azo-5-oxo-4H-pyrazole-3-carboxylate
IUPAC Name: tetrasodium 1-[3-[[4-chloro-6-(4-sulfoanilino)-1,3,5-triazin-2-yl]amino]-2-methyl-5-sulfonatophenyl]-4-[[4-[[4-chloro-6-(4-sulfonatoanilino)-1,3,5-triazin-2-yl]amino]-2-sulfonatophenyl]diazenyl]-5-oxo-4H-pyrazole-3-carboxylate
SYSTEMATIC NAME: tetrasodium 4-[[4-[[4-chloranyl-6-[(4-sulfonatophenyl)amino]-1,3,5-triazin-2-yl]amino]-2-sulfonato-phenyl]diazenyl]-1-[3-[[4-chloranyl-6-[(4-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]-2-methyl-5-sulfonato-phenyl]-5-oxidanylidene-4H-pyrazole-3-carboxylat
MOLECULAR FORMULA: C35H22Cl2N14Na4O15S4
MOLECULAR WEIGHT: 1169.75906
SMILES: CC1=C(C=C(C=C1N2C(=O)C(C(=N2)C(=O)[O-])N=NC3=C(C=C(C=C3)NC4=NC(=NC(=N4)NC5=CC=C(C=C5)S(=O)(=O)[O-])Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])NC6=NC(=NC(=N6)NC7=CC=C(C=C7)S(=O)(=O)O)Cl.[Na+].[Na+].[Na+].[Na+]
Structure:
CAS RN: 70996-01-9
CAS Name: hexadecanoic acid [(6aR,10aS)-1-hydroxy-6,6-dimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c][1]benzopyran-10-yl]methyl ester
OPENEYE Name: [(6aR,10aS)-1-hydroxy-6,6-dimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromen-10-yl]methyl hexadecanoate
IUPAC Name: [(6aR,10aS)-1-hydroxy-6,6-dimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromen-10-yl]methyl hexadecanoate
SYSTEMATIC NAME: [(6aR,10aS)-6,6-dimethyl-1-oxidanyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromen-10-yl]methyl hexadecanoate
MOLECULAR FORMULA: C37H60O4
MOLECULAR WEIGHT: 568.8699
SMILES: CCCCCCCCCCCCCCCC(=O)OCC1=CCC[C@@H]2[C@@H]1C3=C(C=C(C=C3O)CCCCC)OC2(C)C
Structure:
CAS RN: 70983-56-1
CAS Name: copper; N'-(2-aminoethyl)ethane-1,2-diamine; 2-cyanoguanidine; dichloride; hydrochloride
OPENEYE Name: copper; N'-(2-aminoethyl)ethane-1,2-diamine; 2-cyanoguanidine; dichloride; hydrochloride
IUPAC Name: copper; N'-(2-aminoethyl)ethane-1,2-diamine; 2-cyanoguanidine; dichloride; hydrochloride
SYSTEMATIC NAME: copper; N'-(2-azanylethyl)ethane-1,2-diamine; 2-cyanoguanidine; dichloride; hydrochloride
MOLECULAR FORMULA: C6H18Cl3CuN7
MOLECULAR WEIGHT: 358.15902
SMILES: C(CNCCN)N.C(#N)N=C(N)N.Cl.[Cl-].[Cl-].[Cu+2]
Structure:
CAS RN: 70983-50-5
CAS Name: disodium; sulfuric acid; zirconium(4+); carbonate; silicate
OPENEYE Name: disodium; sulfuric acid; zirconium(4+); carbonate; silicate
IUPAC Name: disodium; sulfuric acid; zirconium(4+); carbonate; silicate
SYSTEMATIC NAME: disodium; sulfuric acid; zirconium(4+); carbonate; silicate
MOLECULAR FORMULA: CH2Na2O11SSiZr
MOLECULAR WEIGHT: 387.37402
SMILES: C(=O)([O-])[O-].OS(=O)(=O)O.[O-][Si]([O-])([O-])[O-].[Na+].[Na+].[Zr+4]
Structure:
CAS RN: 70969-62-9
CAS Name: 1-dodecanethiol; 2-methylenebutanoic acid; 2-methyl-2-propenoic acid; 2-methyl-2-propenoic acid methyl ester; 2-propenoic acid
OPENEYE Name: acrylic acid; dodecane-1-thiol; 2-methylenebutanoic acid; methyl 2-methylprop-2-enoate; 2-methylprop-2-enoic acid
IUPAC Name: dodecane-1-thiol; 2-methylidenebutanoic acid; methyl 2-methylprop-2-enoate; 2-methylprop-2-enoic acid; prop-2-enoic acid
SYSTEMATIC NAME: dodecane-1-thiol; 2-methylidenebutanoic acid; methyl 2-methylprop-2-enoate; 2-methylprop-2-enoic acid; prop-2-enoic acid
MOLECULAR FORMULA: C29H52O8S
MOLECULAR WEIGHT: 560.78338
SMILES: CCCCCCCCCCCCS.CCC(=C)C(=O)O.CC(=C)C(=O)O.CC(=C)C(=O)OC.C=CC(=O)O
Structure:
CAS RN: 70955-70-3
CAS Name: 3,3-dimethyl-2-methylenebicyclo[2.2.1]heptane; 2-methoxyphenol
OPENEYE Name: 2,2-dimethyl-3-methylene-norbornane; 2-methoxyphenol
IUPAC Name: 3,3-dimethyl-2-methylidenebicyclo[2.2.1]heptane; 2-methoxyphenol
SYSTEMATIC NAME: 3,3-dimethyl-2-methylidene-bicyclo[2.2.1]heptane; 2-methoxyphenol
MOLECULAR FORMULA: C17H24O2
MOLECULAR WEIGHT: 260.37126
SMILES: CC1(C2CCC(C2)C1=C)C.COC1=CC=CC=C1O
Structure:
CAS RN: 70942-44-8
CAS Name: 2-hydroxyethyl-dimethyl-[3-[(2-methyl-1-oxoprop-2-enyl)amino]propyl]ammonium acetate
OPENEYE Name: 2-hydroxyethyl-dimethyl-[3-(2-methylprop-2-enoylamino)propyl]ammonium acetate
IUPAC Name: 2-hydroxyethyl-dimethyl-[3-(2-methylprop-2-enoylamino)propyl]azanium acetate
SYSTEMATIC NAME: 2-hydroxyethyl-dimethyl-[3-(2-methylprop-2-enoylamino)propyl]azanium ethanoate
MOLECULAR FORMULA: C13H26N2O4
MOLECULAR WEIGHT: 274.35654
SMILES: CC(=C)C(=O)NCCC[N+](C)(C)CCO.CC(=O)[O-]
Structure:
CAS RN: 70942-12-0
CAS Name: 2-methyl-2-propenoic acid dodecyl ester; 2-methyl-2-propenoic acid ethyl ester; 2-propenoic acid 2-hydroxyethyl ester; styrene
OPENEYE Name: dodecyl 2-methylprop-2-enoate; ethyl 2-methylprop-2-enoate; 2-hydroxyethyl prop-2-enoate; styrene
IUPAC Name: dodecyl 2-methylprop-2-enoate; ethyl 2-methylprop-2-enoate; 2-hydroxyethyl prop-2-enoate; styrene
SYSTEMATIC NAME: dodecyl 2-methylprop-2-enoate; ethenylbenzene; ethyl 2-methylprop-2-enoate; 2-hydroxyethyl prop-2-enoate
MOLECULAR FORMULA: C35H56O7
MOLECULAR WEIGHT: 588.81494
SMILES: CCCCCCCCCCCCOC(=O)C(=C)C.CCOC(=O)C(=C)C.C=CC1=CC=CC=C1.C=CC(=O)OCCO
Structure:
CAS RN: 70901-60-9
CAS Name: (3R)-6,8-dihydroxy-3-methyl-3,4-dihydro-1H-2-benzopyran-1-one
OPENEYE Name: (3R)-6,8-dihydroxy-3-methyl-isochroman-1-one
IUPAC Name: (3R)-6,8-dihydroxy-3-methyl-3,4-dihydroisochromen-1-one
SYSTEMATIC NAME: (3R)-3-methyl-6,8-bis(oxidanyl)-3,4-dihydroisochromen-1-one
MOLECULAR FORMULA: C10H10O4
MOLECULAR WEIGHT: 194.184
SMILES: C[C@@H]1CC2=CC(=CC(=C2C(=O)O1)O)O
Structure:
CAS RN: 70900-45-7
CAS Name: trisodium 4-[5-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2-sulfonatophenyl]azo-5-oxo-1-(4-sulfonatophenyl)-4H-pyrazole-3-carboxylate
OPENEYE Name: trisodium 4-[5-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2-sulfonato-phenyl]azo-5-oxo-1-(4-sulfonatophenyl)-4H-pyrazole-3-carboxylate
IUPAC Name: trisodium 4-[[5-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2-sulfonatophenyl]diazenyl]-5-oxo-1-(4-sulfonatophenyl)-4H-pyrazole-3-carboxylate
SYSTEMATIC NAME: trisodium 4-[[5-[[4,6-bis(chloranyl)-1,3,5-triazin-2-yl]amino]-2-sulfonato-phenyl]diazenyl]-5-oxidanylidene-1-(4-sulfonatophenyl)-4H-pyrazole-3-carboxylate
MOLECULAR FORMULA: C19H9Cl2N8Na3O9S2
MOLECULAR WEIGHT: 697.32827
SMILES: C1=CC(=CC=C1N2C(=O)C(C(=N2)C(=O)[O-])N=NC3=C(C=CC(=C3)NC4=NC(=NC(=N4)Cl)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]
Structure:
CAS RN: 97404-00-7
CAS Name: trisodium 4-[5-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2-sulfonatophenyl]azo-5-oxo-1-(4-sulfonatophenyl)-4H-pyrazole-3-carboxylate
OPENEYE Name: trisodium 4-[5-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2-sulfonato-phenyl]azo-5-oxo-1-(4-sulfonatophenyl)-4H-pyrazole-3-carboxylate
IUPAC Name: trisodium 4-[[5-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2-sulfonatophenyl]diazenyl]-5-oxo-1-(4-sulfonatophenyl)-4H-pyrazole-3-carboxylate
SYSTEMATIC NAME: trisodium 4-[[5-[[4,6-bis(chloranyl)-1,3,5-triazin-2-yl]amino]-2-sulfonato-phenyl]diazenyl]-5-oxidanylidene-1-(4-sulfonatophenyl)-4H-pyrazole-3-carboxylate
MOLECULAR FORMULA: C19H9Cl2N8Na3O9S2
MOLECULAR WEIGHT: 697.32827
SMILES: C1=CC(=CC=C1N2C(=O)C(C(=N2)C(=O)[O-])N=NC3=C(C=CC(=C3)NC4=NC(=NC(=N4)Cl)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]
Structure:
CAS RN: 70900-41-3
CAS Name: trisodium 1-amino-4-[3-[[4-chloro-6-(4-sulfonatophenoxy)-1,3,5-triazin-2-yl]amino]-2,4,6-trimethyl-5-sulfonatoanilino]-9,10-dioxo-2-anthracenesulfonate
OPENEYE Name: trisodium 1-amino-4-[3-[[4-chloro-6-(4-sulfonatophenoxy)-1,3,5-triazin-2-yl]amino]-2,4,6-trimethyl-5-sulfonato-anilino]-9,10-dioxo-anthracene-2-sulfonate
IUPAC Name: trisodium 1-amino-4-[3-[[4-chloro-6-(4-sulfonatophenoxy)-1,3,5-triazin-2-yl]amino]-2,4,6-trimethyl-5-sulfonatoanilino]-9,10-dioxoanthracene-2-sulfonate
SYSTEMATIC NAME: trisodium 1-azanyl-4-[[3-[[4-chloranyl-6-(4-sulfonatophenoxy)-1,3,5-triazin-2-yl]amino]-2,4,6-trimethyl-5-sulfonato-phenyl]amino]-9,10-bis(oxidanylidene)anthracene-2-sulfonate
MOLECULAR FORMULA: C32H22ClN6Na3O12S3
MOLECULAR WEIGHT: 883.16739
SMILES: CC1=C(C(=C(C(=C1NC2=NC(=NC(=N2)Cl)OC3=CC=C(C=C3)S(=O)(=O)[O-])C)S(=O)(=O)[O-])C)NC4=CC(=C(C5=C4C(=O)C6=CC=CC=C6C5=O)N)S(=O)(=O)[O-].[Na+].[Na+].[Na+]
Structure:
CAS RN: 70900-27-5
CAS Name: disodium 1,4-bis[4-(benzenesulfonyloxy)butan-2-ylimino]anthracene-9,10-diolate
OPENEYE Name: disodium 1,4-bis[[3-(benzenesulfonyloxy)-1-methyl-propyl]imino]anthracene-9,10-diolate
IUPAC Name: disodium 1,4-bis[4-(benzenesulfonyloxy)butan-2-ylimino]anthracene-9,10-diolate
SYSTEMATIC NAME: disodium 1,4-bis[4-(phenylsulfonyloxy)butan-2-ylimino]anthracene-9,10-diolate
MOLECULAR FORMULA: C34H32N2Na2O8S2
MOLECULAR WEIGHT: 706.73602
SMILES: CC(CCOS(=O)(=O)C1=CC=CC=C1)N=C2C=CC(=NC(C)CCOS(=O)(=O)C3=CC=CC=C3)C4=C(C5=CC=CC=C5C(=C24)[O-])[O-].[Na+].[Na+]
Structure:
CAS RN: 70893-01-5
CAS Name: N'-(2-aminoethyl)ethane-1,2-diamine; 2-cyanoguanidine; hydrochloride
OPENEYE Name: N'-(2-aminoethyl)ethane-1,2-diamine; 2-cyanoguanidine; hydrochloride
IUPAC Name: N'-(2-aminoethyl)ethane-1,2-diamine; 2-cyanoguanidine; hydrochloride
SYSTEMATIC NAME: N'-(2-azanylethyl)ethane-1,2-diamine; 2-cyanoguanidine; hydrochloride
MOLECULAR FORMULA: C6H18ClN7
MOLECULAR WEIGHT: 223.70702
SMILES: C(CNCCN)N.C(#N)N=C(N)N.Cl
Structure:
CAS RN: 70893-00-4
CAS Name: disodium; 1,2-bis(ethenyl)benzene; 2-[carboxylatomethyl-[(2-ethenylphenyl)methyl]amino]acetate; 2-methyl-2-propenoic acid 2,2-bis[(2-methyl-1-oxoprop-2-enoxy)methyl]butyl ester
OPENEYE Name: disodium; 2,2-bis(2-methylprop-2-enoyloxymethyl)butyl 2-methylprop-2-enoate; 2-[carboxylatomethyl-[(2-vinylphenyl)methyl]amino]acetate; 1,2-divinylbenzene
IUPAC Name: disodium; 1,2-bis(ethenyl)benzene; 2,2-bis(2-methylprop-2-enoyloxymethyl)butyl 2-methylprop-2-enoate; 2-[carboxylatomethyl-[(2-ethenylphenyl)methyl]amino]acetate
SYSTEMATIC NAME: disodium; 1,2-bis(ethenyl)benzene; 2,2-bis(2-methylprop-2-enoyloxymethyl)butyl 2-methylprop-2-enoate; 2-[(2-ethenylphenyl)methyl-(2-oxidanidyl-2-oxidanylidene-ethyl)amino]ethanoate
MOLECULAR FORMULA: C41H49NNa2O10
MOLECULAR WEIGHT: 761.808
SMILES: CCC(COC(=O)C(=C)C)(COC(=O)C(=C)C)COC(=O)C(=C)C.C=CC1=CC=CC=C1CN(CC(=O)[O-])CC(=O)[O-].C=CC1=CC=CC=C1C=C.[Na+].[Na+]
Structure:
CAS RN: 70892-90-9
CAS Name: 2-methyl-2-propenoic acid; 2-methyl-2-propenoic acid butyl ester; 2-methyl-2-propenoic acid methyl ester; 2-methyl-2-propenoic acid 2-(3-oxazolidinyl)ethyl ester
OPENEYE Name: butyl 2-methylprop-2-enoate; methyl 2-methylprop-2-enoate; 2-methylprop-2-enoic acid; 2-oxazolidin-3-ylethyl 2-methylprop-2-enoate
IUPAC Name: butyl 2-methylprop-2-enoate; methyl 2-methylprop-2-enoate; 2-methylprop-2-enoic acid; 2-(1,3-oxazolidin-3-yl)ethyl 2-methylprop-2-enoate
SYSTEMATIC NAME: butyl 2-methylprop-2-enoate; methyl 2-methylprop-2-enoate; 2-methylprop-2-enoic acid; 2-(1,3-oxazolidin-3-yl)ethyl 2-methylprop-2-enoate
MOLECULAR FORMULA: C26H43NO9
MOLECULAR WEIGHT: 513.62092
SMILES: CCCCOC(=O)C(=C)C.CC(=C)C(=O)O.CC(=C)C(=O)OC.CC(=C)C(=O)OCCN1CCOC1
Structure:
CAS RN: 70892-40-9
CAS Name: 2-azepanone; 1,3-diisocyanato-2-methylbenzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; 2-methyloxirane; oxirane; propane-1,2,3-triol
OPENEYE Name: azepan-2-one; 1,3-diisocyanato-2-methyl-benzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; glycerol; 2-methyloxirane; oxirane
IUPAC Name: azepan-2-one; 1,3-diisocyanato-2-methylbenzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; 2-methyloxirane; oxirane; propane-1,2,3-triol
SYSTEMATIC NAME: azepan-2-one; 1,3-diisocyanato-2-methyl-benzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; 2-methyloxirane; oxirane; propane-1,2,3-triol
MOLECULAR FORMULA: C29H49N3O11
MOLECULAR WEIGHT: 615.71286
SMILES: CCC(CO)(CO)CO.CC1CO1.CC1=C(C=CC=C1N=C=O)N=C=O.C1CCC(=O)NCC1.C1CO1.C(C(CO)O)O
Structure:
CAS RN: 70892-33-0
CAS Name: benzene-1,3-diamine; formaldehyde; sulfane
OPENEYE Name: benzene-1,3-diamine; formaldehyde; hydrogen sulfide
IUPAC Name: benzene-1,3-diamine; formaldehyde; sulfane
SYSTEMATIC NAME: benzene-1,3-diamine; methanal; sulfane
MOLECULAR FORMULA: C7H12N2OS
MOLECULAR WEIGHT: 172.24798
SMILES: C=O.C1=CC(=CC(=C1)N)N.S
Structure:
CAS RN: 70892-21-6
CAS Name: acetic acid ethenyl ester; ethenol; 1-isocyanatohexadecane; 1-isocyanatooctadecane
OPENEYE Name: ethenol; 1-isocyanatohexadecane; 1-isocyanatooctadecane; vinyl acetate
IUPAC Name: ethenol; ethenyl acetate; 1-isocyanatohexadecane; 1-isocyanatooctadecane
SYSTEMATIC NAME: ethenol; ethenyl ethanoate; 1-isocyanatohexadecane; 1-isocyanatooctadecane
MOLECULAR FORMULA: C42H80N2O5
MOLECULAR WEIGHT: 693.095
SMILES: CCCCCCCCCCCCCCCCCCN=C=O.CCCCCCCCCCCCCCCCN=C=O.CC(=O)OC=C.C=CO
Structure:
CAS RN: 70879-66-2
CAS Name: N',N'-dimethylpropane-1,3-diamine; 12-hydroxyoctadecanoic acid; sulfuric acid dimethyl ester
OPENEYE Name: N',N'-dimethylpropane-1,3-diamine; dimethyl sulfate; 12-hydroxyoctadecanoic acid
IUPAC Name: N',N'-dimethylpropane-1,3-diamine; dimethyl sulfate; 12-hydroxyoctadecanoic acid
SYSTEMATIC NAME: N',N'-dimethylpropane-1,3-diamine; dimethyl sulfate; 12-oxidanyloctadecanoic acid
MOLECULAR FORMULA: C25H56N2O7S
MOLECULAR WEIGHT: 528.78634
SMILES: CCCCCCC(CCCCCCCCCCC(=O)O)O.CN(C)CCCN.COS(=O)(=O)OC
Structure:
CAS RN: 70879-35-5
CAS Name: benzene-1,3-dicarboxylic acid; cyclohexanamine; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexane-1,6-diamine; hexanedioic acid
OPENEYE Name: adipic acid; cyclohexanamine; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexane-1,6-diamine; isophthalic acid
IUPAC Name: benzene-1,3-dicarboxylic acid; cyclohexanamine; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexane-1,6-diamine; hexanedioic acid
SYSTEMATIC NAME: benzene-1,3-dicarboxylic acid; cyclohexanamine; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexane-1,6-diamine; hexanedioic acid
MOLECULAR FORMULA: C32H59N3O11
MOLECULAR WEIGHT: 661.82436
SMILES: CCC(CO)(CO)CO.C1CCC(CC1)N.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(CCCN)CCN.C(CCC(=O)O)CC(=O)O
Structure:
CAS RN: 70879-34-4
CAS Name: 3-(aminomethyl)-3,5,5-trimethyl-1-cyclohexanamine; benzene-1,3-dicarboxylic acid; cyclohexanamine; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid
OPENEYE Name: adipic acid; 3-(aminomethyl)-3,5,5-trimethyl-cyclohexanamine; cyclohexanamine; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; isophthalic acid
IUPAC Name: 3-(aminomethyl)-3,5,5-trimethylcyclohexan-1-amine; benzene-1,3-dicarboxylic acid; cyclohexanamine; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid
SYSTEMATIC NAME: 3-(aminomethyl)-3,5,5-trimethyl-cyclohexan-1-amine; benzene-1,3-dicarboxylic acid; cyclohexanamine; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid
MOLECULAR FORMULA: C36H65N3O11
MOLECULAR WEIGHT: 715.9148
SMILES: CCC(CO)(CO)CO.CC1(CC(CC(C1)(C)CN)N)C.C1CCC(CC1)N.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(CCC(=O)O)CC(=O)O
Structure:
CAS RN: 70869-38-4
CAS Name: 2-hydroxy-3-(3-trihydroxysilylpropoxy)-1-propanesulfonic acid
OPENEYE Name: 2-hydroxy-3-(3-trihydroxysilylpropoxy)propane-1-sulfonic acid
IUPAC Name: 2-hydroxy-3-(3-trihydroxysilylpropoxy)propane-1-sulfonic acid
SYSTEMATIC NAME: 2-oxidanyl-3-[3-tris(oxidanyl)silylpropoxy]propane-1-sulfonic acid
MOLECULAR FORMULA: C6H16O8SSi
MOLECULAR WEIGHT: 276.33694
SMILES: C(COCC(CS(=O)(=O)O)O)C[Si](O)(O)O
Structure:
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