CAS RN: 72596-00-0
CAS Name: (3,4-diaminophenyl)-phenylmethanone; platinum(2+); dichloride
OPENEYE Name: (3,4-diaminophenyl)-phenyl-methanone; platinum(2+); dichloride
IUPAC Name: (3,4-diaminophenyl)-phenylmethanone; platinum(2+); dichloride
SYSTEMATIC NAME: [3,4-bis(azanyl)phenyl]-phenyl-methanone; platinum(2+); dichloride
MOLECULAR FORMULA: C13H12Cl2N2OPt
MOLECULAR WEIGHT: 478.23118
SMILES: C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)N)N.[Cl-].[Cl-].[Pt+2]
Structure:
CAS RN: 75378-84-6
CAS Name: methanesulfenic acid [(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-2-oxolanyl]methyl ester
OPENEYE Name: 1-[(2R,4S,5R)-4-hydroxy-5-(methylsulfanyloxymethyl)tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione
IUPAC Name: 1-[(2R,4S,5R)-4-hydroxy-5-(methylsulfanyloxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
SYSTEMATIC NAME: 5-methyl-1-[(2R,4S,5R)-5-(methylsulfanyloxymethyl)-4-oxidanyl-oxolan-2-yl]pyrimidine-2,4-dione
MOLECULAR FORMULA: C11H16N2O5S
MOLECULAR WEIGHT: 288.32014
SMILES: CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)COSC)O
Structure:
CAS RN: 75332-44-4
CAS Name: (8R,9S,10R,13S,14S)-10,13-dimethyl-7,8,9,11,12,14,15,16-octahydrocyclopenta[a]phenanthrene-3,6,17-trione
OPENEYE Name: (8R,9S,10R,13S,14S)-10,13-dimethyl-7,8,9,11,12,14,15,16-octahydrocyclopenta[a]phenanthrene-3,6,17-trione
IUPAC Name: (8R,9S,10R,13S,14S)-10,13-dimethyl-7,8,9,11,12,14,15,16-octahydrocyclopenta[a]phenanthrene-3,6,17-trione
SYSTEMATIC NAME: (8R,9S,10R,13S,14S)-10,13-dimethyl-7,8,9,11,12,14,15,16-octahydrocyclopenta[a]phenanthrene-3,6,17-trione
MOLECULAR FORMULA: C19H22O3
MOLECULAR WEIGHT: 298.37618
SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CC(=O)C4=CC(=O)C=C[C@]34C
Structure:
CAS RN: 72596-01-1
CAS Name: platinum(2+); 3,4,5-trichlorobenzene-1,2-diamine; dichloride
OPENEYE Name: platinum(2+); 3,4,5-trichlorobenzene-1,2-diamine; dichloride
IUPAC Name: platinum(2+); 3,4,5-trichlorobenzene-1,2-diamine; dichloride
SYSTEMATIC NAME: platinum(2+); 3,4,5-tris(chloranyl)benzene-1,2-diamine; dichloride
MOLECULAR FORMULA: C6H5Cl5N2Pt
MOLECULAR WEIGHT: 477.4603
SMILES: C1=C(C(=C(C(=C1Cl)Cl)Cl)N)N.[Cl-].[Cl-].[Pt+2]
Structure:
CAS RN: 7505-49-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H12O2
MOLECULAR WEIGHT: 260.28668
SMILES: C1=CC2=C3C(=C1)C=C4[C@@H]([C@@H](C5=C4C3=C(C=C2)C=C5)O)O
Structure:
CAS RN: 7505-45-5
CAS Name: (6aS,9S)-3,9-dihydroxy-2-methoxy-5,6,6a,7,8,9-hexahydropyrrolo[2,1-c][1,4]benzodiazepin-11-one
OPENEYE Name: (6aS,9S)-3,9-dihydroxy-2-methoxy-5,6,6a,7,8,9-hexahydropyrrolo[2,1-c][1,4]benzodiazepin-11-one
IUPAC Name: (6aS,9S)-3,9-dihydroxy-2-methoxy-5,6,6a,7,8,9-hexahydropyrrolo[2,1-c][1,4]benzodiazepin-11-one
SYSTEMATIC NAME: (6aS,9S)-2-methoxy-3,9-bis(oxidanyl)-5,6,6a,7,8,9-hexahydropyrrolo[2,1-c][1,4]benzodiazepin-11-one
MOLECULAR FORMULA: C13H16N2O4
MOLECULAR WEIGHT: 264.27714
SMILES: COC1=C(C=C2C(=C1)C(=O)N3[C@@H](CC[C@@H]3O)CN2)O
Structure:
CAS RN: 71743-09-4
CAS Name: 4-[bis(2-chloroethyl)amino]-N-propylbenzamide
OPENEYE Name: 4-[bis(2-chloroethyl)amino]-N-propyl-benzamide
IUPAC Name: 4-[bis(2-chloroethyl)amino]-N-propylbenzamide
SYSTEMATIC NAME: 4-[bis(2-chloroethyl)amino]-N-propyl-benzamide
MOLECULAR FORMULA: C14H20Cl2N2O
MOLECULAR WEIGHT: 303.2274
SMILES: CCCNC(=O)C1=CC=C(C=C1)N(CCCl)CCCl
Structure:
CAS RN: 71339-08-7
CAS Name: 2,2-bis(4-chlorophenyl)oxirane
OPENEYE Name: 2,2-bis(4-chlorophenyl)oxirane
IUPAC Name: 2,2-bis(4-chlorophenyl)oxirane
SYSTEMATIC NAME: 2,2-bis(4-chlorophenyl)oxirane
MOLECULAR FORMULA: C14H10Cl2O
MOLECULAR WEIGHT: 265.1346
SMILES: C1C(O1)(C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl
Structure:
CAS RN: 75921-61-8
CAS Name: 1-[2-(2,4-dichlorophenyl)-2-hydroxyethyl]imidazolidine-2,4-dione
OPENEYE Name: 1-[2-(2,4-dichlorophenyl)-2-hydroxy-ethyl]imidazolidine-2,4-dione
IUPAC Name: 1-[2-(2,4-dichlorophenyl)-2-hydroxyethyl]imidazolidine-2,4-dione
SYSTEMATIC NAME: 1-[2-(2,4-dichlorophenyl)-2-oxidanyl-ethyl]imidazolidine-2,4-dione
MOLECULAR FORMULA: C11H10Cl2N2O3
MOLECULAR WEIGHT: 289.1147
SMILES: C1C(=O)NC(=O)N1CC(C2=C(C=C(C=C2)Cl)Cl)O
Structure:
CAS RN: 71162-54-4
CAS Name: 1-[2-(2,4-dichlorophenyl)-2-hydroxyethyl]imidazolidine-2,4-dione
OPENEYE Name: 1-[2-(2,4-dichlorophenyl)-2-hydroxy-ethyl]imidazolidine-2,4-dione
IUPAC Name: 1-[2-(2,4-dichlorophenyl)-2-hydroxyethyl]imidazolidine-2,4-dione
SYSTEMATIC NAME: 1-[2-(2,4-dichlorophenyl)-2-oxidanyl-ethyl]imidazolidine-2,4-dione
MOLECULAR FORMULA: C11H10Cl2N2O3
MOLECULAR WEIGHT: 289.1147
SMILES: C1C(=O)NC(=O)N1CC(C2=C(C=C(C=C2)Cl)Cl)O
Structure:
CAS RN: 73863-50-0
CAS Name: 3,5,6,8-tetramethoxy-1-methyl-9,10-dioxo-7-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]-2-anthracenecarboxylic acid methyl ester
OPENEYE Name: methyl 3,5,6,8-tetramethoxy-1-methyl-9,10-dioxo-7-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]anthracene-2-carboxylate
IUPAC Name: methyl 3,5,6,8-tetramethoxy-1-methyl-9,10-dioxo-7-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]anthracene-2-carboxylate
SYSTEMATIC NAME: methyl 7-[(2S,3R,4R,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]-3,5,6,8-tetramethoxy-1-methyl-9,10-bis(oxidanylidene)anthracene-2-carboxylate
MOLECULAR FORMULA: C27H30O13
MOLECULAR WEIGHT: 562.5193
SMILES: CC1=C2C(=CC(=C1C(=O)OC)OC)C(=O)C3=C(C2=O)C(=C(C(=C3OC)OC)[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)OC
Structure:
CAS RN: 70945-65-2
CAS Name: 1,4-dihydroxy-5,8-bis[2-(1-piperazinyl)ethylamino]anthracene-9,10-dione
OPENEYE Name: 1,4-dihydroxy-5,8-bis(2-piperazin-1-ylethylamino)anthracene-9,10-dione
IUPAC Name: 1,4-dihydroxy-5,8-bis(2-piperazin-1-ylethylamino)anthracene-9,10-dione
SYSTEMATIC NAME: 1,4-bis(oxidanyl)-5,8-bis(2-piperazin-1-ylethylamino)anthracene-9,10-dione
MOLECULAR FORMULA: C26H34N6O4
MOLECULAR WEIGHT: 494.58596
SMILES: C1CN(CCN1)CCNC2=C3C(=C(C=C2)NCCN4CCNCC4)C(=O)C5=C(C=CC(=C5C3=O)O)O
Structure:
CAS RN: 73794-59-9
CAS Name: 1,4-bis[2-(dimethylamino)ethylamino]-6-methylanthracene-9,10-dione
OPENEYE Name: 1,4-bis[2-(dimethylamino)ethylamino]-6-methyl-anthracene-9,10-dione
IUPAC Name: 1,4-bis[2-(dimethylamino)ethylamino]-6-methylanthracene-9,10-dione
SYSTEMATIC NAME: 1,4-bis[2-(dimethylamino)ethylamino]-6-methyl-anthracene-9,10-dione
MOLECULAR FORMULA: C23H30N4O2
MOLECULAR WEIGHT: 394.5099
SMILES: CC1=CC2=C(C=C1)C(=O)C3=C(C=CC(=C3C2=O)NCCN(C)C)NCCN(C)C
Structure:
CAS RN: 72928-48-4
CAS Name: N-butyl-N-(2-oxoethyl)nitrous amide
OPENEYE Name: N-butyl-N-(2-oxoethyl)nitrous amide
IUPAC Name: N-butyl-N-(2-oxoethyl)nitrous amide
SYSTEMATIC NAME: N-butyl-N-(2-oxidanylideneethyl)nitrous amide
MOLECULAR FORMULA: C6H12N2O2
MOLECULAR WEIGHT: 144.17168
SMILES: CCCCN(CC=O)N=O
Structure:
CAS RN: 73352-74-6
CAS Name: 1,5-bis[3-(dimethylamino)propylamino]anthracene-9,10-dione
OPENEYE Name: 1,5-bis[3-(dimethylamino)propylamino]anthracene-9,10-dione
IUPAC Name: 1,5-bis[3-(dimethylamino)propylamino]anthracene-9,10-dione
SYSTEMATIC NAME: 1,5-bis[3-(dimethylamino)propylamino]anthracene-9,10-dione
MOLECULAR FORMULA: C24H32N4O2
MOLECULAR WEIGHT: 408.53648
SMILES: CN(C)CCCNC1=CC=CC2=C1C(=O)C3=C(C2=O)C(=CC=C3)NCCCN(C)C
Structure:
CAS RN: 70597-91-0
CAS Name: 1,3-bis(3-methoxyphenyl)propane-1,3-dione
OPENEYE Name: 1,3-bis(3-methoxyphenyl)propane-1,3-dione
IUPAC Name: 1,3-bis(3-methoxyphenyl)propane-1,3-dione
SYSTEMATIC NAME: 1,3-bis(3-methoxyphenyl)propane-1,3-dione
MOLECULAR FORMULA: C17H16O4
MOLECULAR WEIGHT: 284.30654
SMILES: COC1=CC=CC(=C1)C(=O)CC(=O)C2=CC(=CC=C2)OC
Structure:
CAS RN: 72782-43-5
CAS Name: 1,4-dihydroxy-5,8-bis[2-[2-(methylamino)ethylamino]ethylamino]anthracene-9,10-dione tetrahydrochloride
OPENEYE Name: 1,4-dihydroxy-5,8-bis[2-[2-(methylamino)ethylamino]ethylamino]anthracene-9,10-dione tetrahydrochloride
IUPAC Name: 1,4-dihydroxy-5,8-bis[2-[2-(methylamino)ethylamino]ethylamino]anthracene-9,10-dione tetrahydrochloride
SYSTEMATIC NAME: 1,4-bis[2-[2-(methylamino)ethylamino]ethylamino]-5,8-bis(oxidanyl)anthracene-9,10-dione tetrahydrochloride
MOLECULAR FORMULA: C24H38Cl4N6O4
MOLECULAR WEIGHT: 616.40832
SMILES: CNCCNCCNC1=C2C(=C(C=C1)NCCNCCNC)C(=O)C3=C(C=CC(=C3C2=O)O)O.Cl.Cl.Cl.Cl
Structure:
CAS RN: 70476-81-2
CAS Name: 1,4-bis(2-aminoethylamino)-5,8-dihydroxyanthracene-9,10-dione dihydrochloride
OPENEYE Name: 1,4-bis(2-aminoethylamino)-5,8-dihydroxy-anthracene-9,10-dione dihydrochloride
IUPAC Name: 1,4-bis(2-aminoethylamino)-5,8-dihydroxyanthracene-9,10-dione dihydrochloride
SYSTEMATIC NAME: 1,4-bis(2-azanylethylamino)-5,8-bis(oxidanyl)anthracene-9,10-dione dihydrochloride
MOLECULAR FORMULA: C18H22Cl2N4O4
MOLECULAR WEIGHT: 429.29768
SMILES: C1=CC(=C2C(=C1NCCN)C(=O)C3=C(C=CC(=C3C2=O)O)O)NCCN.Cl.Cl
Structure:
CAS RN: 72771-51-8
CAS Name: 1,4-dihydroxy-5,8-bis[2-(methylamino)ethylamino]anthracene-9,10-dione dihydrochloride
OPENEYE Name: 1,4-dihydroxy-5,8-bis[2-(methylamino)ethylamino]anthracene-9,10-dione dihydrochloride
IUPAC Name: 1,4-dihydroxy-5,8-bis[2-(methylamino)ethylamino]anthracene-9,10-dione dihydrochloride
SYSTEMATIC NAME: 1,4-bis[2-(methylamino)ethylamino]-5,8-bis(oxidanyl)anthracene-9,10-dione dihydrochloride
MOLECULAR FORMULA: C20H26Cl2N4O4
MOLECULAR WEIGHT: 457.35084
SMILES: CNCCNC1=C2C(=C(C=C1)NCCNC)C(=O)C3=C(C=CC(=C3C2=O)O)O.Cl.Cl
Structure:
CAS RN: 72758-40-8
CAS Name: 1,4-bis[2-(dimethylamino)ethylamino]-5,8-dihydroxyanthracene-9,10-dione
OPENEYE Name: 1,4-bis[2-(dimethylamino)ethylamino]-5,8-dihydroxy-anthracene-9,10-dione
IUPAC Name: 1,4-bis[2-(dimethylamino)ethylamino]-5,8-dihydroxyanthracene-9,10-dione
SYSTEMATIC NAME: 1,4-bis[2-(dimethylamino)ethylamino]-5,8-bis(oxidanyl)anthracene-9,10-dione
MOLECULAR FORMULA: C22H28N4O4
MOLECULAR WEIGHT: 412.48212
SMILES: CN(C)CCNC1=C2C(=C(C=C1)NCCN(C)C)C(=O)C3=C(C=CC(=C3C2=O)O)O
Structure:
CAS RN: 72718-33-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H15NO4
MOLECULAR WEIGHT: 321.3267
SMILES: COC1=CC2=C(C=C1)C3=C4C(=CC(=C3OC)OC)C=CN=C4C2=O
Structure:
CAS RN: 71653-49-1
CAS Name: 5-acenaphthylenecarbonitrile
OPENEYE Name: acenaphthylene-5-carbonitrile
IUPAC Name: acenaphthylene-5-carbonitrile
SYSTEMATIC NAME: acenaphthylene-5-carbonitrile
MOLECULAR FORMULA: C13H7N
MOLECULAR WEIGHT: 177.20138
SMILES: C1=CC2=C(C=CC3=C2C(=C1)C=C3)C#N
Structure:
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