CAS RN: 68400-61-3
CAS Name: 2-cyanoguanidine; formaldehyde; oxalic acid; phenol
OPENEYE Name: 2-cyanoguanidine; formaldehyde; oxalic acid; phenol
IUPAC Name: 2-cyanoguanidine; formaldehyde; oxalic acid; phenol
SYSTEMATIC NAME: 2-cyanoguanidine; ethanedioic acid; methanal; phenol
MOLECULAR FORMULA: C11H14N4O6
MOLECULAR WEIGHT: 298.25206
SMILES: C=O.C1=CC=C(C=C1)O.C(#N)N=C(N)N.C(=O)(C(=O)O)O
Structure:
CAS RN: 68400-33-9
CAS Name: tetrasodium 2-[3-[(2E)-2-[6-[[[[(6Z)-6-[[3-[[carboxylato(oxo)methyl]amino]phenyl]hydrazinylidene]-5-oxo-7-sulfonato-2-naphthalenyl]amino]-oxomethyl]amino]-1-oxo-3-sulfonato-2-naphthalenylidene]hydrazinyl]anilino]-2-oxoacetate
OPENEYE Name: tetrasodium 2-[3-[(2E)-2-[6-[[(6Z)-6-[[3-[(carboxylatoformyl)amino]phenyl]hydrazono]-5-oxo-7-sulfonato-2-naphthyl]carbamoylamino]-1-oxo-3-sulfonato-2-naphthylidene]hydrazino]anilino]-2-oxo-acetate
IUPAC Name: tetrasodium 2-[3-[(2E)-2-[6-[[(6Z)-6-[[3-[(carboxylatoformyl)amino]phenyl]hydrazinylidene]-5-oxo-7-sulfonatonaphthalen-2-yl]carbamoylamino]-1-oxo-3-sulfonatonaphthalen-2-ylidene]hydrazinyl]anilino]-2-oxoacetate
SYSTEMATIC NAME: tetrasodium 2-[[3-[(2E)-2-[6-[[(6Z)-6-[[3-[(2-oxidanidyl-2-oxidanylidene-ethanoyl)amino]phenyl]hydrazinylidene]-5-oxidanylidene-7-sulfonato-naphthalen-2-yl]carbamoylamino]-1-oxidanylidene-3-sulfonato-naphthalen-2-ylidene]hydrazinyl]phenyl]amino]-2-oxidany
MOLECULAR FORMULA: C37H22N8Na4O15S2
MOLECULAR WEIGHT: 974.70426
SMILES: C1=CC(=CC(=C1)N/N=C/2\C(=CC3=C(C2=O)C=CC(=C3)NC(=O)NC4=CC5=C(C=C4)C(=O)/C(=N\NC6=CC=CC(=C6)NC(=O)C(=O)[O-])/C(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])NC(=O)C(=O)[O-].[Na+].[Na+].[Na+].[Na+]
Structure:
CAS RN: 68400-17-9
CAS Name: formaldehyde; 2-furancarboxaldehyde; 2-hydroxypropanoic acid; phenol
OPENEYE Name: formaldehyde; furan-2-carbaldehyde; 2-hydroxypropanoic acid; phenol
IUPAC Name: formaldehyde; furan-2-carbaldehyde; 2-hydroxypropanoic acid; phenol
SYSTEMATIC NAME: furan-2-carbaldehyde; methanal; 2-oxidanylpropanoic acid; phenol
MOLECULAR FORMULA: C15H18O7
MOLECULAR WEIGHT: 310.29922
SMILES: CC(C(=O)O)O.C=O.C1=CC=C(C=C1)O.C1=COC(=C1)C=O
Structure:
CAS RN: 68400-15-7
CAS Name: (2R,3R,4S,5S,6R)-2-[[(2R,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)-2-oxolanyl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol; formaldehyde; 2-(2-hydroxyethoxy)ethanol; 1,3,5-triazine-2,4,6-triamine
OPENEYE Name: (2R,3R,4S,5S,6R)-2-[(2R,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)tetrahydrofuran-2-yl]oxy-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol; formaldehyde; 2-(2-hydroxyethoxy)ethanol; 1,3,5-triazine-2,4,6-triamine
IUPAC Name: (2R,3R,4S,5S,6R)-2-[(2R,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol; formaldehyde; 2-(2-hydroxyethoxy)ethanol; 1,3,5-triazine-2,4,6-triamine
SYSTEMATIC NAME: (2R,3R,4S,5S,6R)-2-[(2R,3S,4S,5R)-2,5-bis(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol; 2-(2-hydroxyethyloxy)ethanol; methanal; 1,3,5-triazine-2,4,6-triamine
MOLECULAR FORMULA: C20H40N6O15
MOLECULAR WEIGHT: 604.5628
SMILES: C=O.C(COCCO)O.C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@]2([C@H]([C@@H]([C@H](O2)CO)O)O)CO)O)O)O)O.C1(=NC(=NC(=N1)N)N)N
Structure:
CAS RN: 68400-14-6
CAS Name: 2-cyanoguanidine; ethane-1,2-diamine; formaldehyde; sulfuric acid
OPENEYE Name: 2-cyanoguanidine; ethane-1,2-diamine; formaldehyde; sulfuric acid
IUPAC Name: 2-cyanoguanidine; ethane-1,2-diamine; formaldehyde; sulfuric acid
SYSTEMATIC NAME: 2-cyanoguanidine; ethane-1,2-diamine; methanal; sulfuric acid
MOLECULAR FORMULA: C5H16N6O5S
MOLECULAR WEIGHT: 272.28274
SMILES: C=O.C(CN)N.C(#N)N=C(N)N.OS(=O)(=O)O
Structure:
CAS RN: 68400-12-4
CAS Name: furan-2,5-dione; 4-[2-(4-hydroxycyclohexyl)propan-2-yl]-1-cyclohexanol; 1-[4-[2-[4-(2-hydroxypropoxy)phenyl]propan-2-yl]phenoxy]-2-propanol
OPENEYE Name: furan-2,5-dione; 4-[1-(4-hydroxycyclohexyl)-1-methyl-ethyl]cyclohexanol; 1-[4-[1-[4-(2-hydroxypropoxy)phenyl]-1-methyl-ethyl]phenoxy]propan-2-ol
IUPAC Name: furan-2,5-dione; 4-[2-(4-hydroxycyclohexyl)propan-2-yl]cyclohexan-1-ol; 1-[4-[2-[4-(2-hydroxypropoxy)phenyl]propan-2-yl]phenoxy]propan-2-ol
SYSTEMATIC NAME: furan-2,5-dione; 4-[2-(4-oxidanylcyclohexyl)propan-2-yl]cyclohexan-1-ol; 1-[4-[2-[4-(2-oxidanylpropoxy)phenyl]propan-2-yl]phenoxy]propan-2-ol
MOLECULAR FORMULA: C40H58O9
MOLECULAR WEIGHT: 682.88312
SMILES: CC(COC1=CC=C(C=C1)C(C)(C)C2=CC=C(C=C2)OCC(C)O)O.CC(C)(C1CCC(CC1)O)C2CCC(CC2)O.C1=CC(=O)OC1=O
Structure:
CAS RN: 109836-57-9
CAS Name: 2-(chloromethyl)oxirane; 3-[(E)-dodec-1-enyl]oxolane-2,5-dione; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
OPENEYE Name: 2-(chloromethyl)oxirane; 3-[(E)-dodec-1-enyl]tetrahydrofuran-2,5-dione; 4-[1-(4-hydroxyphenyl)-1-methyl-ethyl]phenol
IUPAC Name: 2-(chloromethyl)oxirane; 3-[(E)-dodec-1-enyl]oxolane-2,5-dione; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
SYSTEMATIC NAME: 2-(chloromethyl)oxirane; 3-[(E)-dodec-1-enyl]oxolane-2,5-dione; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
MOLECULAR FORMULA: C34H47ClO6
MOLECULAR WEIGHT: 587.18638
SMILES: CCCCCCCCCC/C=C/C1CC(=O)OC1=O.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl
Structure:
CAS RN: 68399-66-6
CAS Name: 2-(chloromethyl)oxirane; 3-[(E)-dodec-1-enyl]oxolane-2,5-dione; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
OPENEYE Name: 2-(chloromethyl)oxirane; 3-[(E)-dodec-1-enyl]tetrahydrofuran-2,5-dione; 4-[1-(4-hydroxyphenyl)-1-methyl-ethyl]phenol
IUPAC Name: 2-(chloromethyl)oxirane; 3-[(E)-dodec-1-enyl]oxolane-2,5-dione; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
SYSTEMATIC NAME: 2-(chloromethyl)oxirane; 3-[(E)-dodec-1-enyl]oxolane-2,5-dione; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
MOLECULAR FORMULA: C34H47ClO6
MOLECULAR WEIGHT: 587.18638
SMILES: CCCCCCCCCC/C=C/C1CC(=O)OC1=O.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl
Structure:
CAS RN: 68399-63-3
CAS Name: hexasodium N'-[2-[bis(phosphonatomethyl)amino]ethyl]-N'-(phosphonatomethyl)ethane-1,2-diamine
OPENEYE Name: hexasodium N'-[2-[bis(phosphonatomethyl)amino]ethyl]-N'-(phosphonatomethyl)ethane-1,2-diamine
IUPAC Name: hexasodium N'-[2-[bis(phosphonatomethyl)amino]ethyl]-N'-(phosphonatomethyl)ethane-1,2-diamine
SYSTEMATIC NAME: hexasodium N'-[2-[bis(phosphonatomethyl)amino]ethyl]-N'-(phosphonatomethyl)ethane-1,2-diamine
MOLECULAR FORMULA: C7H16N3Na6O9P3
MOLECULAR WEIGHT: 517.076543
SMILES: C(CN(CCN(CP(=O)([O-])[O-])CP(=O)([O-])[O-])CP(=O)([O-])[O-])N.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]
Structure:
CAS RN: 68392-94-9
CAS Name: N,N-diethylethanamine; 3-[(2Z)-5-methoxy-2-[[1-(3-sulfonatopropyl)-5,9b-dihydrobenzo[e][1,3]benzothiazol-1-ium-2-yl]methylidene]-1,3-benzothiazol-3-yl]-1-propanesulfonate
OPENEYE Name: N,N-diethylethanamine; 3-[(2Z)-5-methoxy-2-[[1-(3-sulfonatopropyl)-5,9b-dihydrobenzo[e][1,3]benzothiazol-1-ium-2-yl]methylene]-1,3-benzothiazol-3-yl]propane-1-sulfonate
IUPAC Name: N,N-diethylethanamine; 3-[(2Z)-5-methoxy-2-[[1-(3-sulfonatopropyl)-5,9b-dihydrobenzo[e][1,3]benzothiazol-1-ium-2-yl]methylidene]-1,3-benzothiazol-3-yl]propane-1-sulfonate
SYSTEMATIC NAME: N,N-diethylethanamine; 3-[(2Z)-5-methoxy-2-[[1-(3-sulfonatopropyl)-5,9b-dihydrobenzo[e][1,3]benzothiazol-1-ium-2-yl]methylidene]-1,3-benzothiazol-3-yl]propane-1-sulfonate
MOLECULAR FORMULA: C32H42N3O7S4-
MOLECULAR WEIGHT: 708.95178
SMILES: CCN(CC)CC.COC1=CC2=C(C=C1)S/C(=C\C3=[N+](C4C(=CCC5=CC=CC=C45)S3)CCCS(=O)(=O)[O-])/N2CCCS(=O)(=O)[O-]
Structure:
CAS RN: 68391-34-4
CAS Name: ammonia; formaldehyde; 2-methyloxirane; oxirane; phenol
OPENEYE Name: ammonia; formaldehyde; 2-methyloxirane; oxirane; phenol
IUPAC Name: azane; formaldehyde; 2-methyloxirane; oxirane; phenol
SYSTEMATIC NAME: azane; methanal; 2-methyloxirane; oxirane; phenol
MOLECULAR FORMULA: C12H21NO4
MOLECULAR WEIGHT: 243.29944
SMILES: CC1CO1.C=O.C1CO1.C1=CC=C(C=C1)O.N
Structure:
CAS RN: 87737-28-8
CAS Name: ammonia; formaldehyde; 2-methyloxirane; oxirane; phenol
OPENEYE Name: ammonia; formaldehyde; 2-methyloxirane; oxirane; phenol
IUPAC Name: azane; formaldehyde; 2-methyloxirane; oxirane; phenol
SYSTEMATIC NAME: azane; methanal; 2-methyloxirane; oxirane; phenol
MOLECULAR FORMULA: C12H21NO4
MOLECULAR WEIGHT: 243.29944
SMILES: CC1CO1.C=O.C1CO1.C1=CC=C(C=C1)O.N
Structure:
CAS RN: 68391-18-4
CAS Name: 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-(1-piperazinyl)ethanamine
OPENEYE Name: 2-(chloromethyl)oxirane; 4-[1-(4-hydroxyphenyl)-1-methyl-ethyl]phenol; 2-piperazin-1-ylethanamine
IUPAC Name: 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-piperazin-1-ylethanamine
SYSTEMATIC NAME: 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-piperazin-1-ylethanamine
MOLECULAR FORMULA: C24H36ClN3O3
MOLECULAR WEIGHT: 450.01394
SMILES: CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1CN(CCN1)CCN.C1C(O1)CCl
Structure:
CAS RN: 68389-77-5
CAS Name: 2-[bis(2-phosphonooxyethyl)amino]ethyl dihydrogen phosphate; 2-(4,5-dihydroimidazol-1-yl)ethanamine
OPENEYE Name: 2-[bis(2-phosphonooxyethyl)amino]ethyl dihydrogen phosphate; 2-(4,5-dihydroimidazol-1-yl)ethanamine
IUPAC Name: 2-[bis(2-phosphonooxyethyl)amino]ethyl dihydrogen phosphate; 2-(4,5-dihydroimidazol-1-yl)ethanamine
SYSTEMATIC NAME: 2-[bis(2-phosphonooxyethyl)amino]ethyl dihydrogen phosphate; 2-(4,5-dihydroimidazol-1-yl)ethanamine
MOLECULAR FORMULA: C11H29N4O12P3
MOLECULAR WEIGHT: 502.288843
SMILES: C1CN(C=N1)CCN.C(COP(=O)(O)O)N(CCOP(=O)(O)O)CCOP(=O)(O)O
Structure:
CAS RN: 68389-76-4
CAS Name: 2-(4,5-dihydroimidazol-1-yl)ethanamine; 2-dodecylbenzenesulfonic acid
OPENEYE Name: 2-(4,5-dihydroimidazol-1-yl)ethanamine; 2-dodecylbenzenesulfonic acid
IUPAC Name: 2-(4,5-dihydroimidazol-1-yl)ethanamine; 2-dodecylbenzenesulfonic acid
SYSTEMATIC NAME: 2-(4,5-dihydroimidazol-1-yl)ethanamine; 2-dodecylbenzenesulfonic acid
MOLECULAR FORMULA: C23H41N3O3S
MOLECULAR WEIGHT: 439.65494
SMILES: CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)O.C1CN(C=N1)CCN
Structure:
CAS RN: 68389-73-1
CAS Name: 2-(4,5-dihydroimidazol-1-yl)ethanamine; 2-hydroxyacetic acid
OPENEYE Name: 2-(4,5-dihydroimidazol-1-yl)ethanamine; 2-hydroxyacetic acid
IUPAC Name: 2-(4,5-dihydroimidazol-1-yl)ethanamine; 2-hydroxyacetic acid
SYSTEMATIC NAME: 2-(4,5-dihydroimidazol-1-yl)ethanamine; 2-oxidanylethanoic acid
MOLECULAR FORMULA: C7H15N3O3
MOLECULAR WEIGHT: 189.2123
SMILES: C1CN(C=N1)CCN.C(C(=O)O)O
Structure:
CAS RN: 68909-07-9
CAS Name: 2-(4,5-dihydroimidazol-1-yl)ethanamine; 2-hydroxyacetic acid
OPENEYE Name: 2-(4,5-dihydroimidazol-1-yl)ethanamine; 2-hydroxyacetic acid
IUPAC Name: 2-(4,5-dihydroimidazol-1-yl)ethanamine; 2-hydroxyacetic acid
SYSTEMATIC NAME: 2-(4,5-dihydroimidazol-1-yl)ethanamine; 2-oxidanylethanoic acid
MOLECULAR FORMULA: C7H15N3O3
MOLECULAR WEIGHT: 189.2123
SMILES: C1CN(C=N1)CCN.C(C(=O)O)O
Structure:
CAS RN: 68389-65-1
CAS Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; heptanoic acid; 3-hydroxy-2,2-dimethylpropanoic acid (3-hydroxy-2,2-dimethylpropyl) ester; isobenzofuran-1,3-dione
OPENEYE Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; heptanoic acid; (3-hydroxy-2,2-dimethyl-propyl) 3-hydroxy-2,2-dimethyl-propanoate; isobenzofuran-1,3-dione
IUPAC Name: 2-benzofuran-1,3-dione; 2,2-bis(hydroxymethyl)propane-1,3-diol; heptanoic acid; (3-hydroxy-2,2-dimethylpropyl) 3-hydroxy-2,2-dimethylpropanoate
SYSTEMATIC NAME: 2-benzofuran-1,3-dione; 2,2-bis(hydroxymethyl)propane-1,3-diol; (2,2-dimethyl-3-oxidanyl-propyl) 2,2-dimethyl-3-oxidanyl-propanoate; heptanoic acid
MOLECULAR FORMULA: C30H50O13
MOLECULAR WEIGHT: 618.7102
SMILES: CCCCCCC(=O)O.CC(C)(CO)COC(=O)C(C)(C)CO.C1=CC=C2C(=C1)C(=O)OC2=O.C(C(CO)(CO)CO)O
Structure:
CAS RN: 68389-64-0
CAS Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; 3-hydroxy-2,2-dimethylpropanoic acid (3-hydroxy-2,2-dimethylpropyl) ester; isobenzofuran-1,3-dione; nonanoic acid
OPENEYE Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; (3-hydroxy-2,2-dimethyl-propyl) 3-hydroxy-2,2-dimethyl-propanoate; isobenzofuran-1,3-dione; nonanoic acid
IUPAC Name: 2-benzofuran-1,3-dione; 2,2-bis(hydroxymethyl)propane-1,3-diol; (3-hydroxy-2,2-dimethylpropyl) 3-hydroxy-2,2-dimethylpropanoate; nonanoic acid
SYSTEMATIC NAME: 2-benzofuran-1,3-dione; 2,2-bis(hydroxymethyl)propane-1,3-diol; (2,2-dimethyl-3-oxidanyl-propyl) 2,2-dimethyl-3-oxidanyl-propanoate; nonanoic acid
MOLECULAR FORMULA: C32H54O13
MOLECULAR WEIGHT: 646.76336
SMILES: CCCCCCCCC(=O)O.CC(C)(CO)COC(=O)C(C)(C)CO.C1=CC=C2C(=C1)C(=O)OC2=O.C(C(CO)(CO)CO)O
Structure:
CAS RN: 68389-61-7
CAS Name: 2-ethylhexanoic acid 2,2-bis(hydroxymethyl)butyl ester; isobenzofuran-1,3-dione
OPENEYE Name: 2,2-bis(hydroxymethyl)butyl 2-ethylhexanoate; isobenzofuran-1,3-dione
IUPAC Name: 2-benzofuran-1,3-dione; 2,2-bis(hydroxymethyl)butyl 2-ethylhexanoate
SYSTEMATIC NAME: 2-benzofuran-1,3-dione; 2,2-bis(hydroxymethyl)butyl 2-ethylhexanoate
MOLECULAR FORMULA: C22H32O7
MOLECULAR WEIGHT: 408.48528
SMILES: CCCCC(CC)C(=O)OCC(CC)(CO)CO.C1=CC=C2C(=C1)C(=O)OC2=O
Structure:
CAS RN: 68936-94-7
CAS Name: 2-ethylhexanoic acid 2,2-bis(hydroxymethyl)butyl ester; isobenzofuran-1,3-dione
OPENEYE Name: 2,2-bis(hydroxymethyl)butyl 2-ethylhexanoate; isobenzofuran-1,3-dione
IUPAC Name: 2-benzofuran-1,3-dione; 2,2-bis(hydroxymethyl)butyl 2-ethylhexanoate
SYSTEMATIC NAME: 2-benzofuran-1,3-dione; 2,2-bis(hydroxymethyl)butyl 2-ethylhexanoate
MOLECULAR FORMULA: C22H32O7
MOLECULAR WEIGHT: 408.48528
SMILES: CCCCC(CC)C(=O)OCC(CC)(CO)CO.C1=CC=C2C(=C1)C(=O)OC2=O
Structure:
CAS RN: 68389-60-6
CAS Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; dodecanoic acid 2,3-dihydroxypropyl ester; isobenzofuran-1,3-dione
OPENEYE Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; 2,3-dihydroxypropyl dodecanoate; isobenzofuran-1,3-dione
IUPAC Name: 2-benzofuran-1,3-dione; 2,2-bis(hydroxymethyl)propane-1,3-diol; 2,3-dihydroxypropyl dodecanoate
SYSTEMATIC NAME: 2-benzofuran-1,3-dione; 2,2-bis(hydroxymethyl)propane-1,3-diol; 2,3-bis(oxidanyl)propyl dodecanoate
MOLECULAR FORMULA: C28H46O11
MOLECULAR WEIGHT: 558.65824
SMILES: CCCCCCCCCCCC(=O)OCC(CO)O.C1=CC=C2C(=C1)C(=O)OC2=O.C(C(CO)(CO)CO)O
Structure:
CAS RN: 68389-58-2
CAS Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; isobenzofuran-1,3-dione; nonanoic acid (3-hydroxy-2,2-dimethylpropyl) ester
OPENEYE Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; (3-hydroxy-2,2-dimethyl-propyl) nonanoate; isobenzofuran-1,3-dione
IUPAC Name: 2-benzofuran-1,3-dione; 2,2-bis(hydroxymethyl)propane-1,3-diol; (3-hydroxy-2,2-dimethylpropyl) nonanoate
SYSTEMATIC NAME: 2-benzofuran-1,3-dione; 2,2-bis(hydroxymethyl)propane-1,3-diol; (2,2-dimethyl-3-oxidanyl-propyl) nonanoate
MOLECULAR FORMULA: C27H44O10
MOLECULAR WEIGHT: 528.63226
SMILES: CCCCCCCCC(=O)OCC(C)(C)CO.C1=CC=C2C(=C1)C(=O)OC2=O.C(C(CO)(CO)CO)O
Structure:
CAS RN: 68389-56-0
CAS Name: isobenzofuran-1,3-dione; nonanoic acid 2,3-dihydroxypropyl ester
OPENEYE Name: 2,3-dihydroxypropyl nonanoate; isobenzofuran-1,3-dione
IUPAC Name: 2-benzofuran-1,3-dione; 2,3-dihydroxypropyl nonanoate
SYSTEMATIC NAME: 2-benzofuran-1,3-dione; 2,3-bis(oxidanyl)propyl nonanoate
MOLECULAR FORMULA: C20H28O7
MOLECULAR WEIGHT: 380.43212
SMILES: CCCCCCCCC(=O)OCC(CO)O.C1=CC=C2C(=C1)C(=O)OC2=O
Structure:
CAS RN: 68389-55-9
CAS Name: benzoic acid 2-[2-(2-hydroxyethoxy)ethoxy]ethyl ester; phthalic acid
OPENEYE Name: 2-[2-(2-hydroxyethoxy)ethoxy]ethyl benzoate; phthalic acid
IUPAC Name: 2-[2-(2-hydroxyethoxy)ethoxy]ethyl benzoate; phthalic acid
SYSTEMATIC NAME: 2-[2-(2-hydroxyethyloxy)ethoxy]ethyl benzoate; phthalic acid
MOLECULAR FORMULA: C21H24O9
MOLECULAR WEIGHT: 420.40986
SMILES: C1=CC=C(C=C1)C(=O)OCCOCCOCCO.C1=CC=C(C(=C1)C(=O)O)C(=O)O
Structure:
CAS RN: 68389-50-4
CAS Name: 2-cyanoguanidine; formaldehyde; formic acid
OPENEYE Name: 2-cyanoguanidine; formaldehyde; formic acid
IUPAC Name: 2-cyanoguanidine; formaldehyde; formic acid
SYSTEMATIC NAME: 2-cyanoguanidine; methanal; methanoic acid
MOLECULAR FORMULA: C4H8N4O3
MOLECULAR WEIGHT: 160.13132
SMILES: C=O.C(=O)O.C(#N)N=C(N)N
Structure:
CAS RN: 68389-46-8
CAS Name: aniline; tris(4-aminophenyl)methanol
OPENEYE Name: aniline; tris(4-aminophenyl)methanol
IUPAC Name: aniline; tris(4-aminophenyl)methanol
SYSTEMATIC NAME: aniline; tris(4-aminophenyl)methanol
MOLECULAR FORMULA: C25H26N4O
MOLECULAR WEIGHT: 398.50014
SMILES: C1=CC=C(C=C1)N.C1=CC(=CC=C1C(C2=CC=C(C=C2)N)(C3=CC=C(C=C3)N)O)N
Structure:
CAS RN: 68379-09-9
CAS Name: 1,3,3a,4,6,6a-hexahydroimidazo[4,5-d]imidazole-2,5-dione; formaldehyde; N-methylbenzenesulfonamide
OPENEYE Name: 1,3,3a,4,6,6a-hexahydroimidazo[4,5-d]imidazole-2,5-dione; formaldehyde; N-methylbenzenesulfonamide
IUPAC Name: 1,3,3a,4,6,6a-hexahydroimidazo[4,5-d]imidazole-2,5-dione; formaldehyde; N-methylbenzenesulfonamide
SYSTEMATIC NAME: 1,3,3a,4,6,6a-hexahydroimidazo[4,5-d]imidazole-2,5-dione; methanal; N-methylbenzenesulfonamide
MOLECULAR FORMULA: C12H17N5O5S
MOLECULAR WEIGHT: 343.35888
SMILES: CNS(=O)(=O)C1=CC=CC=C1.C=O.C12C(NC(=O)N1)NC(=O)N2
Structure:
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