CAS RN: 97171-72-7
CAS Name: dioxido(sulfido)borane; europium(2+)
OPENEYE Name: dioxido(sulfido)borane; europium(2+)
IUPAC Name: dioxido(sulfido)borane; europium(2+)
SYSTEMATIC NAME: bis(oxidanidyl)-sulfanidyl-borane; europium(2+)
MOLECULAR FORMULA: B2Eu3O4S2
MOLECULAR WEIGHT: 605.6416
SMILES: B([O-])([O-])[S-].B([O-])([O-])[S-].[Eu+2].[Eu+2].[Eu+2]
CAS RN: 94230-69-0
CAS Name: dipotassium [phosphonatomethyl(3,5,5-trimethylhexyl)amino]methylphosphonic acid
OPENEYE Name: dipotassium [phosphonatomethyl(3,5,5-trimethylhexyl)amino]methylphosphonic acid
IUPAC Name: dipotassium [phosphonatomethyl(3,5,5-trimethylhexyl)amino]methylphosphonic acid
SYSTEMATIC NAME: dipotassium [phosphonatomethyl(3,5,5-trimethylhexyl)amino]methylphosphonic acid
MOLECULAR FORMULA: C11H25K2NO6P2
MOLECULAR WEIGHT: 407.463422
SMILES: CC(CCN(CP(=O)(O)O)CP(=O)([O-])[O-])CC(C)(C)C.[K+].[K+]
CAS RN: 93962-80-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H34N2O4
MOLECULAR WEIGHT: 390.51636
SMILES: C1CC2CC1C3C2C(C(C3)COC(=O)CCN4CC4)COC(=O)CCN5CC5
CAS RN: 93805-61-9
CAS Name: 2-(9-butyl-3-carbazolyl)-6-[[4-[4-[(9-butyl-3-carbazolyl)-[2-(4-methylanilino)phenyl]methyl]-N-methylanilino]phenyl]methyl]-N-(4-methylphenyl)aniline
OPENEYE Name: 2-(9-butylcarbazol-3-yl)-6-[[4-[4-[(9-butylcarbazol-3-yl)-[2-(4-methylanilino)phenyl]methyl]-N-methyl-anilino]phenyl]methyl]-N-(p-tolyl)aniline
IUPAC Name: 2-(9-butylcarbazol-3-yl)-6-[[4-[4-[(9-butylcarbazol-3-yl)-[2-(4-methylanilino)phenyl]methyl]-N-methylanilino]phenyl]methyl]-N-(4-methylphenyl)aniline
SYSTEMATIC NAME: 2-(9-butylcarbazol-3-yl)-6-[[4-[[4-[(9-butylcarbazol-3-yl)-[2-[(4-methylphenyl)amino]phenyl]methyl]phenyl]-methyl-amino]phenyl]methyl]-N-(4-methylphenyl)aniline
MOLECULAR FORMULA: C73H69N5
MOLECULAR WEIGHT: 1016.36246
SMILES: CCCCN1C2=C(C=C(C=C2)C3=C(C(=CC=C3)CC4=CC=C(C=C4)N(C)C5=CC=C(C=C5)C(C6=CC7=C(C=C6)N(C8=CC=CC=C87)CCCC)C9=CC=CC=C9NC2=CC=C(C=C2)C)NC2=CC=C(C=C2)C)C2=CC=CC=C21
CAS RN: 120029-06-3
CAS Name: disodium (3E)-7-[[4,6-bis[3-(diethylamino)propylamino]-1,3,5-triazin-2-yl]amino]-4-oxo-3-[[4-(4-sulfonatophenyl)azophenyl]hydrazinylidene]-2-naphthalenesulfonate
OPENEYE Name: disodium (3E)-7-[[4,6-bis[3-(diethylamino)propylamino]-1,3,5-triazin-2-yl]amino]-4-oxo-3-[[4-(4-sulfonatophenyl)azophenyl]hydrazono]naphthalene-2-sulfonate
IUPAC Name: disodium (3E)-7-[[4,6-bis[3-(diethylamino)propylamino]-1,3,5-triazin-2-yl]amino]-4-oxo-3-[[4-[(4-sulfonatophenyl)diazenyl]phenyl]hydrazinylidene]naphthalene-2-sulfonate
SYSTEMATIC NAME: disodium (3E)-7-[[4,6-bis[3-(diethylamino)propylamino]-1,3,5-triazin-2-yl]amino]-4-oxidanylidene-3-[[4-[(4-sulfonatophenyl)diazenyl]phenyl]hydrazinylidene]naphthalene-2-sulfonate
MOLECULAR FORMULA: C39H48N12Na2O7S2
MOLECULAR WEIGHT: 906.98416
SMILES: CCN(CC)CCCNC1=NC(=NC(=N1)NC2=CC3=C(C=C2)C(=O)/C(=N\NC4=CC=C(C=C4)N=NC5=CC=C(C=C5)S(=O)(=O)[O-])/C(=C3)S(=O)(=O)[O-])NCCCN(CC)CC.[Na+].[Na+]
CAS RN: 94292-28-1
CAS Name: 7-[(4S)-3-[(3S)-3-cyclohexyl-3-hydroxypropyl]-2,5-dioxo-4-imidazolidinyl]heptanoic acid ethyl ester
OPENEYE Name: ethyl 7-[(4S)-3-[(3S)-3-cyclohexyl-3-hydroxy-propyl]-2,5-dioxo-imidazolidin-4-yl]heptanoate
IUPAC Name: ethyl 7-[(4S)-3-[(3S)-3-cyclohexyl-3-hydroxypropyl]-2,5-dioxoimidazolidin-4-yl]heptanoate
SYSTEMATIC NAME: ethyl 7-[(4S)-3-[(3S)-3-cyclohexyl-3-oxidanyl-propyl]-2,5-bis(oxidanylidene)imidazolidin-4-yl]heptanoate
MOLECULAR FORMULA: C21H36N2O5
MOLECULAR WEIGHT: 396.52094
SMILES: CCOC(=O)CCCCCC[C@H]1C(=O)NC(=O)N1CC[C@@H](C2CCCCC2)O
CAS RN: 120206-84-0
CAS Name: (6Z)-4-amino-3-(4-nitrophenyl)azo-5-oxo-6-(phenylhydrazinylidene)naphthalene-2,7-disulfonic acid; 3-(2-ethylhexoxy)-1-propanamine
OPENEYE Name: (6Z)-4-amino-3-(4-nitrophenyl)azo-5-oxo-6-(phenylhydrazono)naphthalene-2,7-disulfonic acid; 3-(2-ethylhexoxy)propan-1-amine
IUPAC Name: (6Z)-4-amino-3-[(4-nitrophenyl)diazenyl]-5-oxo-6-(phenylhydrazinylidene)naphthalene-2,7-disulfonic acid; 3-(2-ethylhexoxy)propan-1-amine
SYSTEMATIC NAME: (6Z)-4-azanyl-3-[(4-nitrophenyl)diazenyl]-5-oxidanylidene-6-(phenylhydrazinylidene)naphthalene-2,7-disulfonic acid; 3-(2-ethylhexoxy)propan-1-amine
MOLECULAR FORMULA: C44H66N8O11S2
MOLECULAR WEIGHT: 947.17184
SMILES: CCCCC(CC)COCCCN.CCCCC(CC)COCCCN.C1=CC=C(C=C1)N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)[N+](=O)[O-])S(=O)(=O)O)S(=O)(=O)O
CAS RN: 85409-81-0
CAS Name: 2-benzoyl-5-methylbenzoic acid 2-[(2-benzoyl-5-methylphenyl)-oxomethoxy]ethyl ester
OPENEYE Name: 2-(2-benzoyl-5-methyl-benzoyl)oxyethyl 2-benzoyl-5-methyl-benzoate
IUPAC Name: 2-(2-benzoyl-5-methylbenzoyl)oxyethyl 2-benzoyl-5-methylbenzoate
SYSTEMATIC NAME: 2-[5-methyl-2-(phenylcarbonyl)phenyl]carbonyloxyethyl 5-methyl-2-(phenylcarbonyl)benzoate
MOLECULAR FORMULA: C32H26O6
MOLECULAR WEIGHT: 506.54524
SMILES: CC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)C(=O)OCCOC(=O)C3=C(C=CC(=C3)C)C(=O)C4=CC=CC=C4
CAS RN: 15907-04-7
CAS Name: benzoic acid; lead
OPENEYE Name: benzoic acid; lead
IUPAC Name: benzoic acid; lead
SYSTEMATIC NAME: benzoic acid; lead
MOLECULAR FORMULA: C7H6O2Pb
MOLECULAR WEIGHT: 329.32134
SMILES: C1=CC=C(C=C1)C(=O)O.[Pb]
CAS RN: 94158-91-5
CAS Name: (9Z,12Z)-2-[formyl(2-hydroxyethyl)amino]octadeca-9,12-dienoic acid ethyl ester
OPENEYE Name: ethyl (9Z,12Z)-2-[formyl(2-hydroxyethyl)amino]octadeca-9,12-dienoate
IUPAC Name: ethyl (9Z,12Z)-2-[formyl(2-hydroxyethyl)amino]octadeca-9,12-dienoate
SYSTEMATIC NAME: ethyl (9Z,12Z)-2-[2-hydroxyethyl(methanoyl)amino]octadeca-9,12-dienoate
MOLECULAR FORMULA: C23H41NO4
MOLECULAR WEIGHT: 395.57594
SMILES: CCCCC/C=C\C/C=C\CCCCCCC(C(=O)OCC)N(CCO)C=O
CAS RN: 125328-99-6
CAS Name: 2-aminoethanol; morpholine; nonanedioic acid
OPENEYE Name: 2-aminoethanol; morpholine; nonanedioic acid
IUPAC Name: 2-aminoethanol; morpholine; nonanedioic acid
SYSTEMATIC NAME: 2-azanylethanol; morpholine; nonanedioic acid
MOLECULAR FORMULA: C15H32N2O6
MOLECULAR WEIGHT: 336.42438
SMILES: C1COCCN1.C(CCCC(=O)O)CCCC(=O)O.C(CO)N
CAS RN: 94113-28-7
CAS Name: 3-[1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]propanoic acid 5-[3-[1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-1-oxopropoxy]pentyl ester; formic acid
OPENEYE Name: 5-[3-[1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]propanoyloxy]pentyl 3-[1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]propanoate; formic acid
IUPAC Name: 5-[3-[1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]propanoyloxy]pentyl 3-[1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]propanoate; formic acid
SYSTEMATIC NAME: 5-[3-[1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]propanoyloxy]pentyl 3-[1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]propanoate; methanoic acid
MOLECULAR FORMULA: C53H70N2O16
MOLECULAR WEIGHT: 991.1267
SMILES: COC1=C(C=C(C=C1)CC2C3=CC(=C(C=C3CCN2CCC(=O)OCCCCCOC(=O)CCN4CCC5=CC(=C(C=C5C4CC6=CC(=C(C=C6)OC)OC)OC)OC)OC)OC)OC.C(=O)O.C(=O)O
CAS RN: 93963-20-3
CAS Name: 6-(1-ethoxyethoxymethyl)-2-methylocta-2,6-diene
OPENEYE Name: 6-(1-ethoxyethoxymethyl)-2-methyl-octa-2,6-diene
IUPAC Name: 6-(1-ethoxyethoxymethyl)-2-methylocta-2,6-diene
SYSTEMATIC NAME: 6-(1-ethoxyethoxymethyl)-2-methyl-octa-2,6-diene
MOLECULAR FORMULA: C14H26O2
MOLECULAR WEIGHT: 226.35504
SMILES: CCOC(C)OCC(=CC)CCC=C(C)C
CAS RN: 114650-76-9
CAS Name: acetic acid ethenyl ester; 1-ethenyl-2-azepanone; 1-ethenyl-2-pyrrolidinone
OPENEYE Name: vinyl acetate; 1-vinylazepan-2-one; 1-vinylpyrrolidin-2-one
IUPAC Name: ethenyl acetate; 1-ethenylazepan-2-one; 1-ethenylpyrrolidin-2-one
SYSTEMATIC NAME: 1-ethenylazepan-2-one; ethenyl ethanoate; 1-ethenylpyrrolidin-2-one
MOLECULAR FORMULA: C18H28N2O4
MOLECULAR WEIGHT: 336.42592
SMILES: CC(=O)OC=C.C=CN1CCCCCC1=O.C=CN1CCCC1=O
CAS RN: 69563-80-0
CAS Name: potassium 1-amino-4-(benzenesulfonamido)-9,10-dioxo-2-anthracenesulfonate
OPENEYE Name: potassium 1-amino-4-(benzenesulfonamido)-9,10-dioxo-anthracene-2-sulfonate
IUPAC Name: potassium 1-amino-4-(benzenesulfonamido)-9,10-dioxoanthracene-2-sulfonate
SYSTEMATIC NAME: potassium 1-azanyl-9,10-bis(oxidanylidene)-4-(phenylsulfonylamino)anthracene-2-sulfonate
MOLECULAR FORMULA: C20H13KN2O7S2
MOLECULAR WEIGHT: 496.55472
SMILES: C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-].[K+]
CAS RN: 94021-18-8
CAS Name: 3-[[9,10-dioxo-4-[3-(trimethylammonio)propylamino]-1-anthracenyl]amino]propyl-trimethylammonium dihydroxide
OPENEYE Name: 3-[[9,10-dioxo-4-[3-(trimethylammonio)propylamino]-1-anthryl]amino]propyl-trimethyl-ammonium dihydroxide
IUPAC Name: 3-[[9,10-dioxo-4-[3-(trimethylazaniumyl)propylamino]anthracen-1-yl]amino]propyl-trimethylazanium dihydroxide
SYSTEMATIC NAME: 3-[[9,10-bis(oxidanylidene)-4-[3-(trimethylazaniumyl)propylamino]anthracen-1-yl]amino]propyl-trimethyl-azanium dihydroxide
MOLECULAR FORMULA: C26H40N4O4
MOLECULAR WEIGHT: 472.6202
SMILES: C[N+](C)(C)CCCNC1=C2C(=C(C=C1)NCCC[N+](C)(C)C)C(=O)C3=CC=CC=C3C2=O.[OH-].[OH-]
CAS RN: 75535-20-5
CAS Name: 3-[(E)-2-[1,3-bis(prop-2-enyl)-2-imidazo[4,5-b]quinoxalin-3-iumyl]ethenyl]-2,4-dimethyl-9-pyrazolo[5,1-b]quinazolinone; 4-methylbenzenesulfonate
OPENEYE Name: 3-[(E)-2-(1,3-diallylimidazo[4,5-b]quinoxalin-3-ium-2-yl)vinyl]-2,4-dimethyl-pyrazolo[5,1-b]quinazolin-9-one; 4-methylbenzenesulfonate
IUPAC Name: 3-[(E)-2-[1,3-bis(prop-2-enyl)imidazo[4,5-b]quinoxalin-3-ium-2-yl]ethenyl]-2,4-dimethylpyrazolo[5,1-b]quinazolin-9-one; 4-methylbenzenesulfonate
SYSTEMATIC NAME: 3-[(E)-2-[1,3-bis(prop-2-enyl)imidazo[4,5-b]quinoxalin-3-ium-2-yl]ethenyl]-2,4-dimethyl-pyrazolo[5,1-b]quinazolin-9-one; 4-methylbenzenesulfonate
MOLECULAR FORMULA: C36H33N7O4S
MOLECULAR WEIGHT: 659.75672
SMILES: CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=NN2C(=C1/C=C/C3=[N+](C4=NC5=CC=CC=C5N=C4N3CC=C)CC=C)N(C6=CC=CC=C6C2=O)C
CAS RN: 83846-69-9
CAS Name: (2Z)-3-ethyl-2-[[(3E)-3-[(E)-3-(3-ethyl-1,3-benzothiazol-3-ium-2-yl)prop-2-enylidene]-5,5-dimethyl-1-cyclohexenyl]methylidene]-1,3-benzothiazole iodide
OPENEYE Name: (2Z)-3-ethyl-2-[[(3E)-3-[(E)-3-(3-ethyl-1,3-benzothiazol-3-ium-2-yl)prop-2-enylidene]-5,5-dimethyl-cyclohexen-1-yl]methylene]-1,3-benzothiazole iodide
IUPAC Name: (2Z)-3-ethyl-2-[[(3E)-3-[(E)-3-(3-ethyl-1,3-benzothiazol-3-ium-2-yl)prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]methylidene]-1,3-benzothiazole iodide
SYSTEMATIC NAME: (2Z)-3-ethyl-2-[[(3E)-3-[(E)-3-(3-ethyl-1,3-benzothiazol-3-ium-2-yl)prop-2-enylidene]-5,5-dimethyl-cyclohexen-1-yl]methylidene]-1,3-benzothiazole iodide
MOLECULAR FORMULA: C30H33IN2S2
MOLECULAR WEIGHT: 612.63089
SMILES: CCN\1C2=CC=CC=C2S/C1=C\C3=C/C(=C/C=C/C4=[N+](C5=CC=CC=C5S4)CC)/CC(C3)(C)C.[I-]
CAS RN: 94201-51-1
CAS Name: sodium 1-(1-cyclohexenyl)-5,5-diethylpyrimidin-3-ide-2,4,6-trione
OPENEYE Name: sodium 1-(cyclohexen-1-yl)-5,5-diethyl-hexahydropyrimidin-3-ide-2,4,6-trione
IUPAC Name: sodium 1-(cyclohexen-1-yl)-5,5-diethylpyrimidin-3-ide-2,4,6-trione
SYSTEMATIC NAME: sodium 1-(cyclohexen-1-yl)-5,5-diethyl-pyrimidin-3-ide-2,4,6-trione
MOLECULAR FORMULA: C14H19N2NaO3
MOLECULAR WEIGHT: 286.30203
SMILES: CCC1(C(=O)[N-]C(=O)N(C1=O)C2=CCCCC2)CC.[Na+]
CAS RN: 85392-00-3
CAS Name: methanesulfonic acid; 2-methyl-2,3-dihydroindol-1-amine
OPENEYE Name: methanesulfonic acid; 2-methylindolin-1-amine
IUPAC Name: methanesulfonic acid; 2-methyl-2,3-dihydroindol-1-amine
SYSTEMATIC NAME: methanesulfonic acid; 2-methyl-2,3-dihydroindol-1-amine
MOLECULAR FORMULA: C10H16N2O3S
MOLECULAR WEIGHT: 244.31064
SMILES: CC1CC2=CC=CC=C2N1N.CS(=O)(=O)O
CAS RN: 83249-39-2
CAS Name: disodium 2-[(2-methyl-4-nitroanilino)-(propan-2-ylideneamino)amino]-5-sulfonatobenzoate
OPENEYE Name: disodium 2-[(isopropylideneamino)-(2-methyl-4-nitro-anilino)amino]-5-sulfonato-benzoate
IUPAC Name: disodium 2-[(2-methyl-4-nitroanilino)-(propan-2-ylideneamino)amino]-5-sulfonatobenzoate
SYSTEMATIC NAME: disodium 2-[[(2-methyl-4-nitro-phenyl)amino]-(propan-2-ylideneamino)amino]-5-sulfonato-benzoate
MOLECULAR FORMULA: C17H16N4Na2O7S
MOLECULAR WEIGHT: 466.37608
SMILES: CC1=C(C=CC(=C1)[N+](=O)[O-])NN(C2=C(C=C(C=C2)S(=O)(=O)[O-])C(=O)[O-])N=C(C)C.[Na+].[Na+]
CAS RN: 72361-51-4
CAS Name: 3-[4-[[4-(3-aminophenoxy)butyl-dimethylsilyl]oxy-dimethylsilyl]butoxy]aniline; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; isobenzofuran-1,3-dione
OPENEYE Name: 3-[4-[[4-(3-aminophenoxy)butyl-dimethyl-silyl]oxy-dimethyl-silyl]butoxy]aniline; 4-[1-(4-hydroxyphenyl)-1-methyl-ethyl]phenol; isobenzofuran-1,3-dione
IUPAC Name: 3-[4-[[4-(3-aminophenoxy)butyl-dimethylsilyl]oxy-dimethylsilyl]butoxy]aniline; 2-benzofuran-1,3-dione; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
SYSTEMATIC NAME: 3-[4-[[4-(3-azanylphenoxy)butyl-dimethyl-silyl]oxy-dimethyl-silyl]butoxy]aniline; 2-benzofuran-1,3-dione; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
MOLECULAR FORMULA: C47H60N2O8Si2
MOLECULAR WEIGHT: 837.1589
SMILES: CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C[Si](C)(CCCCOC1=CC=CC(=C1)N)O[Si](C)(C)CCCCOC2=CC=CC(=C2)N.C1=CC=C2C(=C1)C(=O)OC2=O
CAS RN: 94213-54-4
CAS Name: acetic acid; octadecanoic acid 2-aminoethyl ester
OPENEYE Name: acetic acid; 2-aminoethyl octadecanoate
IUPAC Name: acetic acid; 2-aminoethyl octadecanoate
SYSTEMATIC NAME: 2-azanylethyl octadecanoate; ethanoic acid
MOLECULAR FORMULA: C22H45NO4
MOLECULAR WEIGHT: 387.597
SMILES: CCCCCCCCCCCCCCCCCC(=O)OCCN.CC(=O)O
CAS RN: 148556-69-8
CAS Name: sodium; N,N-dimethyl-2-propenamide; 2-methyl-2-propenoate
OPENEYE Name: sodium; N,N-dimethylprop-2-enamide; 2-methylprop-2-enoate
IUPAC Name: sodium; N,N-dimethylprop-2-enamide; 2-methylprop-2-enoate
SYSTEMATIC NAME: sodium; N,N-dimethylprop-2-enamide; 2-methylprop-2-enoate
MOLECULAR FORMULA: C9H14NNaO3
MOLECULAR WEIGHT: 207.20213
SMILES: CC(=C)C(=O)[O-].CN(C)C(=O)C=C.[Na+]
CAS RN: 73398-46-6
CAS Name: sodium 5-[3-carboxy-5-methyl-4-[(4-phenylphenyl)hydrazo]oxyphenyl]azo-6-imino-7-methyl-4-oxo-2-naphthalenesulfonate
OPENEYE Name: sodium 5-[3-carboxy-5-methyl-4-[2-(4-phenylphenyl)hydrazino]oxy-phenyl]azo-6-imino-7-methyl-4-oxo-naphthalene-2-sulfonate
IUPAC Name: sodium 5-[[3-carboxy-5-methyl-4-[2-(4-phenylphenyl)hydrazinyl]oxyphenyl]diazenyl]-6-imino-7-methyl-4-oxonaphthalene-2-sulfonate
SYSTEMATIC NAME: sodium 6-azanylidene-5-[[3-carboxy-5-methyl-4-[2-(4-phenylphenyl)hydrazinyl]oxy-phenyl]diazenyl]-7-methyl-4-oxidanylidene-naphthalene-2-sulfonate
MOLECULAR FORMULA: C31H24N5NaO7S
MOLECULAR WEIGHT: 633.60633
SMILES: CC1=CC2=CC(=CC(=O)C2=C(C1=N)N=NC3=CC(=C(C(=C3)C(=O)O)ONNC4=CC=C(C=C4)C5=CC=CC=C5)C)S(=O)(=O)[O-].[Na+]
CAS RN: 102832-13-3
CAS Name: 2-hydroxypropanoic acid [(Z)-hex-2-enyl] ester
OPENEYE Name: [(Z)-hex-2-enyl] 2-hydroxypropanoate
IUPAC Name: [(Z)-hex-2-enyl] 2-hydroxypropanoate
SYSTEMATIC NAME: [(Z)-hex-2-enyl] 2-oxidanylpropanoate
MOLECULAR FORMULA: C9H16O3
MOLECULAR WEIGHT: 172.22154
SMILES: CCC/C=C\COC(=O)C(C)O
CAS RN: 62220-43-3
CAS Name: sodium N-cyano-N-ethylcarbamate
OPENEYE Name: sodium N-cyano-N-ethyl-carbamate
IUPAC Name: sodium N-cyano-N-ethylcarbamate
SYSTEMATIC NAME: sodium N-cyano-N-ethyl-carbamate
MOLECULAR FORMULA: C4H5N2NaO2
MOLECULAR WEIGHT: 136.08447
SMILES: CCN(C#N)C(=O)[O-].[Na+]
CAS RN: 82799-37-9
CAS Name: (Z)-N-[2-(3-hydroxypropylamino)ethyl]-9-octadecenamide; sulfuric acid methyl ester
OPENEYE Name: (Z)-N-[2-(3-hydroxypropylamino)ethyl]octadec-9-enamide; methyl hydrogen sulfate
IUPAC Name: (Z)-N-[2-(3-hydroxypropylamino)ethyl]octadec-9-enamide; methyl hydrogen sulfate
SYSTEMATIC NAME: methyl hydrogen sulfate; (Z)-N-[2-(3-oxidanylpropylamino)ethyl]octadec-9-enamide
MOLECULAR FORMULA: C24H50N2O6S
MOLECULAR WEIGHT: 494.7286
SMILES: CCCCCCCC/C=C\CCCCCCCC(=O)NCCNCCCO.COS(=O)(=O)O
CAS RN: 85187-67-3
CAS Name: dipotassium; 5-[[4-[bis(2-hydroxyethyl)amino]-6-methoxy-1,3,5-triazin-2-yl]amino]-2-[(E)-2-[4-[[4-[bis(2-hydroxyethyl)amino]-6-methoxy-1,3,5-triazin-2-yl]amino]-2-sulfonatophenyl]ethenyl]benzenesulfonate; 2-(2-hydroxyethylamino)ethanol
OPENEYE Name: dipotassium; 5-[[4-[bis(2-hydroxyethyl)amino]-6-methoxy-1,3,5-triazin-2-yl]amino]-2-[(E)-2-[4-[[4-[bis(2-hydroxyethyl)amino]-6-methoxy-1,3,5-triazin-2-yl]amino]-2-sulfonato-phenyl]vinyl]benzenesulfonate; 2-(2-hydroxyethylamino)ethanol
IUPAC Name: dipotassium; 5-[[4-[bis(2-hydroxyethyl)amino]-6-methoxy-1,3,5-triazin-2-yl]amino]-2-[(E)-2-[4-[[4-[bis(2-hydroxyethyl)amino]-6-methoxy-1,3,5-triazin-2-yl]amino]-2-sulfonatophenyl]ethenyl]benzenesulfonate; 2-(2-hydroxyethylamino)ethanol
SYSTEMATIC NAME: dipotassium; 5-[[4-[bis(2-hydroxyethyl)amino]-6-methoxy-1,3,5-triazin-2-yl]amino]-2-[(E)-2-[4-[[4-[bis(2-hydroxyethyl)amino]-6-methoxy-1,3,5-triazin-2-yl]amino]-2-sulfonato-phenyl]ethenyl]benzenesulfonate; 2-(2-hydroxyethylamino)ethanol
MOLECULAR FORMULA: C34H47K2N11O14S2
MOLECULAR WEIGHT: 976.12888
SMILES: COC1=NC(=NC(=N1)N(CCO)CCO)NC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)NC4=NC(=NC(=N4)OC)N(CCO)CCO)S(=O)(=O)[O-])S(=O)(=O)[O-].C(CO)NCCO.[K+].[K+]
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