CAS RN: 81075-14-1
CAS Name: 1-[(4Z)-6-chloro-4-hydroxyimino-2,3-dihydroquinolin-1-yl]-1-propanone
OPENEYE Name: 1-[(4Z)-6-chloro-4-hydroxyimino-2,3-dihydroquinolin-1-yl]propan-1-one
IUPAC Name: 1-[(4Z)-6-chloro-4-hydroxyimino-2,3-dihydroquinolin-1-yl]propan-1-one
SYSTEMATIC NAME: 1-[(4Z)-6-chloranyl-4-hydroxyimino-2,3-dihydroquinolin-1-yl]propan-1-one
MOLECULAR FORMULA: C12H13ClN2O2
MOLECULAR WEIGHT: 252.69682
SMILES: CCC(=O)N1CC/C(=N/O)/C2=C1C=CC(=C2)Cl
Structure:
CAS RN: 161774-09-0
CAS Name: N-[3-(3-methoxyphenyl)prop-2-ynoxy]-1-azabicyclo[2.2.1]heptan-3-imine; oxalic acid
OPENEYE Name: N-[3-(3-methoxyphenyl)prop-2-ynoxy]-1-azabicyclo[2.2.1]heptan-3-imine; oxalic acid
IUPAC Name: N-[3-(3-methoxyphenyl)prop-2-ynoxy]-1-azabicyclo[2.2.1]heptan-3-imine; oxalic acid
SYSTEMATIC NAME: ethanedioic acid; N-[3-(3-methoxyphenyl)prop-2-ynoxy]-1-azabicyclo[2.2.1]heptan-3-imine
MOLECULAR FORMULA: C18H20N2O6
MOLECULAR WEIGHT: 360.3612
SMILES: COC1=CC=CC(=C1)C#CCO/N=C\2/CN3CCC2C3.C(=O)(C(=O)O)O
Structure:
CAS RN: 130349-07-4
CAS Name: 4-[5-[4-[(E)-amino(hydroxyimino)methyl]phenoxy]pentoxy]benzenecarboximidamide
OPENEYE Name: 4-[5-[4-[(E)-N'-hydroxycarbamimidoyl]phenoxy]pentoxy]benzamidine
IUPAC Name: 4-[5-[4-[(E)-N'-hydroxycarbamimidoyl]phenoxy]pentoxy]benzenecarboximidamide
SYSTEMATIC NAME: 4-[5-[4-[(E)-N'-oxidanylcarbamimidoyl]phenoxy]pentoxy]benzenecarboximidamide
MOLECULAR FORMULA: C19H24N4O3
MOLECULAR WEIGHT: 356.41886
SMILES: C1=CC(=CC=C1C(=N)N)OCCCCCOC2=CC=C(C=C2)/C(=N\O)/N
Structure:
CAS RN: 150151-21-6
CAS Name: (1E)-1-[[4-(2,3-dimethylphenyl)-2,3-dimethylphenyl]hydrazinylidene]-2-naphthalenone
OPENEYE Name: (1E)-1-[[4-(2,3-dimethylphenyl)-2,3-dimethyl-phenyl]hydrazono]naphthalen-2-one
IUPAC Name: (1E)-1-[[4-(2,3-dimethylphenyl)-2,3-dimethylphenyl]hydrazinylidene]naphthalen-2-one
SYSTEMATIC NAME: (1E)-1-[[4-(2,3-dimethylphenyl)-2,3-dimethyl-phenyl]hydrazinylidene]naphthalen-2-one
MOLECULAR FORMULA: C26H24N2O
MOLECULAR WEIGHT: 380.48156
SMILES: CC1=CC=CC(=C1C)C2=C(C(=C(C=C2)N/N=C\3/C(=O)C=CC4=CC=CC=C43)C)C
Structure:
CAS RN: 98891-84-0
CAS Name: 2,4,6-trichloro-N-[(E)-[2-(1-imidazolyl)-1-phenylbutylidene]amino]aniline hydrochloride
OPENEYE Name: 2,4,6-trichloro-N-[(E)-(2-imidazol-1-yl-1-phenyl-butylidene)amino]aniline hydrochloride
IUPAC Name: 2,4,6-trichloro-N-[(E)-(2-imidazol-1-yl-1-phenylbutylidene)amino]aniline hydrochloride
SYSTEMATIC NAME: 2,4,6-tris(chloranyl)-N-[(E)-(2-imidazol-1-yl-1-phenyl-butylidene)amino]aniline hydrochloride
MOLECULAR FORMULA: C19H18Cl4N4
MOLECULAR WEIGHT: 444.18502
SMILES: CCC(/C(=N/NC1=C(C=C(C=C1Cl)Cl)Cl)/C2=CC=CC=C2)N3C=CN=C3.Cl
Structure:
CAS RN: 7059-16-7
CAS Name: 4-methylbenzenesulfonate; 1-[4-[(E)-2-[4-[(E)-2-[4-(1-pyridin-1-iumyl)phenyl]ethenyl]phenyl]ethenyl]phenyl]pyridin-1-ium
OPENEYE Name: 4-methylbenzenesulfonate; 1-[4-[(E)-2-[4-[(E)-2-(4-pyridin-1-ium-1-ylphenyl)vinyl]phenyl]vinyl]phenyl]pyridin-1-ium
IUPAC Name: 4-methylbenzenesulfonate; 1-[4-[(E)-2-[4-[(E)-2-(4-pyridin-1-ium-1-ylphenyl)ethenyl]phenyl]ethenyl]phenyl]pyridin-1-ium
SYSTEMATIC NAME: 4-methylbenzenesulfonate; 1-[4-[(E)-2-[4-[(E)-2-(4-pyridin-1-ium-1-ylphenyl)ethenyl]phenyl]ethenyl]phenyl]pyridin-1-ium
MOLECULAR FORMULA: C46H40N2O6S2
MOLECULAR WEIGHT: 780.9496
SMILES: CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].C1=CC=[N+](C=C1)C2=CC=C(C=C2)/C=C/C3=CC=C(C=C3)/C=C/C4=CC=C(C=C4)[N+]5=CC=CC=C5
Structure:
CAS RN: 103955-21-1
CAS Name: N-[(2E,3R,4R,5S,6R)-4,5-dihydroxy-2-hydroxyimino-6-(hydroxymethyl)-3-oxanyl]acetamide
OPENEYE Name: N-[(2E,3R,4R,5S,6R)-4,5-dihydroxy-2-hydroxyimino-6-(hydroxymethyl)tetrahydropyran-3-yl]acetamide
IUPAC Name: N-[(2E,3R,4R,5S,6R)-4,5-dihydroxy-2-hydroxyimino-6-(hydroxymethyl)oxan-3-yl]acetamide
SYSTEMATIC NAME: N-[(2E,3R,4R,5S,6R)-2-hydroxyimino-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-3-yl]ethanamide
MOLECULAR FORMULA: C8H14N2O6
MOLECULAR WEIGHT: 234.20656
SMILES: CC(=O)N[C@@H]\1[C@H]([C@@H]([C@H](O/C1=N/O)CO)O)O
Structure:
CAS RN: 113411-11-3
CAS Name: (5Z)-3-(2-hydroxyethylthio)-4-oxo-5-[(2-oxo-3-oxazolidinyl)imino]pentanenitrile
OPENEYE Name: (5Z)-3-(2-hydroxyethylsulfanyl)-4-oxo-5-(2-oxooxazolidin-3-yl)imino-pentanenitrile
IUPAC Name: (5Z)-3-(2-hydroxyethylsulfanyl)-4-oxo-5-[(2-oxo-1,3-oxazolidin-3-yl)imino]pentanenitrile
SYSTEMATIC NAME: (5Z)-3-(2-hydroxyethylsulfanyl)-4-oxidanylidene-5-[(2-oxidanylidene-1,3-oxazolidin-3-yl)imino]pentanenitrile
MOLECULAR FORMULA: C10H13N3O4S
MOLECULAR WEIGHT: 271.29292
SMILES: C1COC(=O)N1/N=C\C(=O)C(CC#N)SCCO
Structure:
CAS RN: 32180-77-1
CAS Name: (4Z)-4-[(2-acetylphenyl)hydrazinylidene]-N-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-1-oxo-2-naphthalenecarboxamide
OPENEYE Name: (4Z)-4-[(2-acetylphenyl)hydrazono]-N-[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]-1-oxo-naphthalene-2-carboxamide
IUPAC Name: (4Z)-4-[(2-acetylphenyl)hydrazinylidene]-N-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-1-oxonaphthalene-2-carboxamide
SYSTEMATIC NAME: (4Z)-N-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-4-[(2-ethanoylphenyl)hydrazinylidene]-1-oxidanylidene-naphthalene-2-carboxamide
MOLECULAR FORMULA: C39H47N3O4
MOLECULAR WEIGHT: 621.80818
SMILES: CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=O)C2=C/C(=N/NC3=CC=CC=C3C(=O)C)/C4=CC=CC=C4C2=O)C(C)(C)CC
Structure:
CAS RN: 36505-52-9
CAS Name: 3-[(2E)-2-[4-[(2,4-dimethylanilino)-oxomethyl]-2-oxo-1-naphthalenylidene]hydrazinyl]-4-hydroxybenzenesulfonic acid
OPENEYE Name: 3-[(2E)-2-[4-[(2,4-dimethylphenyl)carbamoyl]-2-oxo-1-naphthylidene]hydrazino]-4-hydroxy-benzenesulfonic acid
IUPAC Name: 3-[(2E)-2-[4-[(2,4-dimethylphenyl)carbamoyl]-2-oxonaphthalen-1-ylidene]hydrazinyl]-4-hydroxybenzenesulfonic acid
SYSTEMATIC NAME: 3-[(2E)-2-[4-[(2,4-dimethylphenyl)carbamoyl]-2-oxidanylidene-naphthalen-1-ylidene]hydrazinyl]-4-oxidanyl-benzenesulfonic acid
MOLECULAR FORMULA: C25H21N3O6S
MOLECULAR WEIGHT: 491.51574
SMILES: CC1=CC(=C(C=C1)NC(=O)C2=CC(=O)/C(=N/NC3=C(C=CC(=C3)S(=O)(=O)O)O)/C4=CC=CC=C42)C
Structure:
CAS RN: 35944-88-8
CAS Name: (1Z)-1-cyano-N-phenoxymethanimidothioic acid diethoxyphosphoryl ester
OPENEYE Name: diethoxyphosphoryl (1Z)-1-cyano-N-phenoxy-methanimidothioate
IUPAC Name: diethoxyphosphoryl (1Z)-1-cyano-N-phenoxymethanimidothioate
SYSTEMATIC NAME: diethoxyphosphoryl (1Z)-1-cyano-N-phenoxy-methanimidothioate
MOLECULAR FORMULA: C12H15N2O4PS
MOLECULAR WEIGHT: 314.297261
SMILES: CCOP(=O)(OCC)S/C(=N\OC1=CC=CC=C1)/C#N
Structure:
CAS RN: 26381-41-9
CAS Name: [(8E)-8-[(4-aminophenyl)hydrazinylidene]-7-oxo-2-naphthalenyl]-trimethylammonium chloride
OPENEYE Name: [(8E)-8-[(4-aminophenyl)hydrazono]-7-oxo-2-naphthyl]-trimethyl-ammonium chloride
IUPAC Name: [(8E)-8-[(4-aminophenyl)hydrazinylidene]-7-oxonaphthalen-2-yl]-trimethylazanium chloride
SYSTEMATIC NAME: [(8E)-8-[(4-aminophenyl)hydrazinylidene]-7-oxidanylidene-naphthalen-2-yl]-trimethyl-azanium chloride
MOLECULAR FORMULA: C19H21ClN4O
MOLECULAR WEIGHT: 356.84924
SMILES: C[N+](C)(C)C1=CC\2=C(C=C1)C=CC(=O)/C2=N/NC3=CC=C(C=C3)N.[Cl-]
Structure:
CAS RN: 13949-49-0
CAS Name: (2-amino-5-chlorophenyl)-(2-chlorophenyl)methanone oxime
OPENEYE Name: (2-amino-5-chloro-phenyl)-(2-chlorophenyl)methanone oxime
IUPAC Name: (NE)-N-[(2-amino-5-chlorophenyl)-(2-chlorophenyl)methylidene]hydroxylamine
SYSTEMATIC NAME: (NE)-N-[(2-azanyl-5-chloranyl-phenyl)-(2-chlorophenyl)methylidene]hydroxylamine
MOLECULAR FORMULA: C13H10Cl2N2O
MOLECULAR WEIGHT: 281.1373
SMILES: C1=CC=C(C(=C1)/C(=N/O)/C2=C(C=CC(=C2)Cl)N)Cl
Structure:
CAS RN: 70693-50-4
CAS Name: (6Z)-6-[(2-nitrophenyl)hydrazinylidene]-2,4-bis(2-phenylpropan-2-yl)-1-cyclohexa-2,4-dienone
OPENEYE Name: (6Z)-2,4-bis(1-methyl-1-phenyl-ethyl)-6-[(2-nitrophenyl)hydrazono]cyclohexa-2,4-dien-1-one
IUPAC Name: (6Z)-6-[(2-nitrophenyl)hydrazinylidene]-2,4-bis(2-phenylpropan-2-yl)cyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: (6Z)-6-[(2-nitrophenyl)hydrazinylidene]-2,4-bis(2-phenylpropan-2-yl)cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C30H29N3O3
MOLECULAR WEIGHT: 479.56956
SMILES: CC(C)(C1=CC=CC=C1)C2=C/C(=N/NC3=CC=CC=C3[N+](=O)[O-])/C(=O)C(=C2)C(C)(C)C4=CC=CC=C4
Structure:
CAS RN: 119386-96-8
CAS Name: (2Z)-2-(fluoromethylidene)-4-(4-fluorophenyl)-1-butanamine
OPENEYE Name: (2Z)-2-(fluoromethylene)-4-(4-fluorophenyl)butan-1-amine
IUPAC Name: (2Z)-2-(fluoromethylidene)-4-(4-fluorophenyl)butan-1-amine
SYSTEMATIC NAME: (2Z)-2-(fluoranylmethylidene)-4-(4-fluorophenyl)butan-1-amine
MOLECULAR FORMULA: C11H13F2N
MOLECULAR WEIGHT: 197.224426
SMILES: C1=CC(=CC=C1CC/C(=C/F)/CN)F
Structure:
CAS RN: 109818-90-8
CAS Name: sodium (3Z)-3-[(3-nitrophenyl)hydrazinylidene]-6-oxo-1-cyclohexa-1,4-dienecarboxylate
OPENEYE Name: sodium (3Z)-3-[(3-nitrophenyl)hydrazono]-6-oxo-cyclohexa-1,4-diene-1-carboxylate
IUPAC Name: sodium (3Z)-3-[(3-nitrophenyl)hydrazinylidene]-6-oxocyclohexa-1,4-diene-1-carboxylate
SYSTEMATIC NAME: sodium (3Z)-3-[(3-nitrophenyl)hydrazinylidene]-6-oxidanylidene-cyclohexa-1,4-diene-1-carboxylate
MOLECULAR FORMULA: C13H8N3NaO5
MOLECULAR WEIGHT: 309.20949
SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])N/N=C\2/C=CC(=O)C(=C2)C(=O)[O-].[Na+]
Structure:
CAS RN: 61763-27-7
CAS Name: sodium (3Z)-3-[(3-nitrophenyl)hydrazinylidene]-6-oxo-1-cyclohexa-1,4-dienecarboxylate
OPENEYE Name: sodium (3Z)-3-[(3-nitrophenyl)hydrazono]-6-oxo-cyclohexa-1,4-diene-1-carboxylate
IUPAC Name: sodium (3Z)-3-[(3-nitrophenyl)hydrazinylidene]-6-oxocyclohexa-1,4-diene-1-carboxylate
SYSTEMATIC NAME: sodium (3Z)-3-[(3-nitrophenyl)hydrazinylidene]-6-oxidanylidene-cyclohexa-1,4-diene-1-carboxylate
MOLECULAR FORMULA: C13H8N3NaO5
MOLECULAR WEIGHT: 309.20949
SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])N/N=C\2/C=CC(=O)C(=C2)C(=O)[O-].[Na+]
Structure:
CAS RN: 76363-76-3
CAS Name: sodium (3Z)-3-[(3-nitrophenyl)hydrazinylidene]-6-oxo-1-cyclohexa-1,4-dienecarboxylate
OPENEYE Name: sodium (3Z)-3-[(3-nitrophenyl)hydrazono]-6-oxo-cyclohexa-1,4-diene-1-carboxylate
IUPAC Name: sodium (3Z)-3-[(3-nitrophenyl)hydrazinylidene]-6-oxocyclohexa-1,4-diene-1-carboxylate
SYSTEMATIC NAME: sodium (3Z)-3-[(3-nitrophenyl)hydrazinylidene]-6-oxidanylidene-cyclohexa-1,4-diene-1-carboxylate
MOLECULAR FORMULA: C13H8N3NaO5
MOLECULAR WEIGHT: 309.20949
SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])N/N=C\2/C=CC(=O)C(=C2)C(=O)[O-].[Na+]
Structure:
CAS RN: 6448-80-2
CAS Name: 4-[(3-carboxylato-2-hydroxy-1-naphthalenyl)methyl]-3-hydroxy-2-naphthalenecarboxylate; 1-[(1E,3E)-5-(2,5-dihydropyrrol-1-ium-1-ylidene)penta-1,3-dienyl]-2,5-dihydropyrrole; hydrate
OPENEYE Name: 4-[(3-carboxylato-2-hydroxy-1-naphthyl)methyl]-3-hydroxy-naphthalene-2-carboxylate; 1-[(1E,3E)-5-(2,5-dihydropyrrol-1-ium-1-ylidene)penta-1,3-dienyl]-2,5-dihydropyrrole; hydrate
IUPAC Name: 4-[(3-carboxylato-2-hydroxynaphthalen-1-yl)methyl]-3-hydroxynaphthalene-2-carboxylate; 1-[(1E,3E)-5-(2,5-dihydropyrrol-1-ium-1-ylidene)penta-1,3-dienyl]-2,5-dihydropyrrole; hydrate
SYSTEMATIC NAME: 4-[(3-carboxylato-2-oxidanyl-naphthalen-1-yl)methyl]-3-oxidanyl-naphthalene-2-carboxylate; 1-[(1E,3E)-5-(2,5-dihydropyrrol-1-ium-1-ylidene)penta-1,3-dienyl]-2,5-dihydropyrrole; hydrate
MOLECULAR FORMULA: C49H50N4O7
MOLECULAR WEIGHT: 806.9439
SMILES: C1N(CC=C1)/C=C/C=C/C=[N+]2CC=CC2.C1N(CC=C1)/C=C/C=C/C=[N+]2CC=CC2.C1=CC=C2C(=C(C(=CC2=C1)C(=O)[O-])O)CC3=C(C(=CC4=CC=CC=C34)C(=O)[O-])O.O
Structure:
CAS RN: 64426-45-5
CAS Name: 1-[(1E,3E)-5-(3,4-dihydro-2H-quinolin-1-ium-1-ylidene)penta-1,3-dienyl]-3,4-dihydro-2H-quinoline chloride hydrate
OPENEYE Name: 1-[(1E,3E)-5-(3,4-dihydro-2H-quinolin-1-ium-1-ylidene)penta-1,3-dienyl]-3,4-dihydro-2H-quinoline chloride hydrate
IUPAC Name: 1-[(1E,3E)-5-(3,4-dihydro-2H-quinolin-1-ium-1-ylidene)penta-1,3-dienyl]-3,4-dihydro-2H-quinoline chloride hydrate
SYSTEMATIC NAME: 1-[(1E,3E)-5-(3,4-dihydro-2H-quinolin-1-ium-1-ylidene)penta-1,3-dienyl]-3,4-dihydro-2H-quinoline chloride hydrate
MOLECULAR FORMULA: C23H27ClN2O
MOLECULAR WEIGHT: 382.92628
SMILES: C1CC2=CC=CC=C2N(C1)/C=C/C=C/C=[N+]3CCCC4=CC=CC=C43.O.[Cl-]
Structure:
CAS RN: 106231-36-1
CAS Name: N-methylcarbamic acid [(E)-(5,5-dimethyl-1,3-oxathiolan-4-ylidene)amino] ester
OPENEYE Name: [(E)-(5,5-dimethyl-1,3-oxathiolan-4-ylidene)amino] N-methylcarbamate
IUPAC Name: [(E)-(5,5-dimethyl-1,3-oxathiolan-4-ylidene)amino] N-methylcarbamate
SYSTEMATIC NAME: [(E)-(5,5-dimethyl-1,3-oxathiolan-4-ylidene)amino] N-methylcarbamate
MOLECULAR FORMULA: C7H12N2O3S
MOLECULAR WEIGHT: 204.24678
SMILES: CC1(/C(=N\OC(=O)NC)/SCO1)C
Structure:
CAS RN: 63979-80-6
CAS Name: (1Z)-1-(1-ethyl-2-benzo[e][1,3]benzothiazolylidene)-2-propanone
OPENEYE Name: (1Z)-1-(1-ethylbenzo[e][1,3]benzothiazol-2-ylidene)propan-2-one
IUPAC Name: (1Z)-1-(1-ethylbenzo[e][1,3]benzothiazol-2-ylidene)propan-2-one
SYSTEMATIC NAME: (1Z)-1-(1-ethylbenzo[e][1,3]benzothiazol-2-ylidene)propan-2-one
MOLECULAR FORMULA: C16H15NOS
MOLECULAR WEIGHT: 269.3614
SMILES: CCN1/C(=C/C(=O)C)/SC2=C1C3=CC=CC=C3C=C2
Structure:
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