CAS RN: 29644-79-9
CAS Name: 6-[(2-nitroanilino)methylidene]-1-cyclohexa-2,4-dienone
OPENEYE Name: 6-[(2-nitroanilino)methylene]cyclohexa-2,4-dien-1-one
IUPAC Name: 6-[(2-nitroanilino)methylidene]cyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: 6-[[(2-nitrophenyl)amino]methylidene]cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C13H10N2O3
MOLECULAR WEIGHT: 242.2301
SMILES: C1=CC=C(C(=C1)NC=C2C=CC=CC2=O)[N+](=O)[O-]
Structure:
CAS RN: 19359-64-9
CAS Name: 8H-pyrimido[5,4-e][1,2,4]triazin-5-one
OPENEYE Name: 8H-pyrimido[5,4-e][1,2,4]triazin-5-one
IUPAC Name: 8H-pyrimido[5,4-e][1,2,4]triazin-5-one
SYSTEMATIC NAME: 8H-pyrimido[5,4-e][1,2,4]triazin-5-one
MOLECULAR FORMULA: C5H3N5O
MOLECULAR WEIGHT: 149.11022
SMILES: C1=NC(=O)C2=C(N1)N=NC=N2
Structure:
CAS RN: 13976-18-6
CAS Name: N-[(5E)-5-[2-(phenylmethyl)-1H-1,2,4-triazol-3-ylidene]-4-imidazolyl]formamide
OPENEYE Name: N-[(5E)-5-(2-benzyl-1H-1,2,4-triazol-3-ylidene)imidazol-4-yl]formamide
IUPAC Name: N-[(5E)-5-(2-benzyl-1H-1,2,4-triazol-3-ylidene)imidazol-4-yl]formamide
SYSTEMATIC NAME: N-[(5E)-5-[2-(phenylmethyl)-1H-1,2,4-triazol-3-ylidene]imidazol-4-yl]methanamide
MOLECULAR FORMULA: C13H12N6O
MOLECULAR WEIGHT: 268.27398
SMILES: C1=CC=C(C=C1)CN2/C(=C/3\C(=NC=N3)NC=O)/N=CN2
Structure:
CAS RN: 40374-26-3
CAS Name: 6-[[(2,2,4-trimethyl-3-bicyclo[2.2.1]heptanyl)amino]methylidene]-1-cyclohexa-2,4-dienone
OPENEYE Name: 6-[[(1,3,3-trimethylnorbornan-2-yl)amino]methylene]cyclohexa-2,4-dien-1-one
IUPAC Name: 6-[[(2,2,4-trimethyl-3-bicyclo[2.2.1]heptanyl)amino]methylidene]cyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: 6-[[(2,2,4-trimethyl-3-bicyclo[2.2.1]heptanyl)amino]methylidene]cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C17H23NO
MOLECULAR WEIGHT: 257.37062
SMILES: CC1(C2CCC(C2)(C1NC=C3C=CC=CC3=O)C)C
Structure:
CAS RN: 56493-02-8
CAS Name: (E)-1,4-bis(1-piperidinyl)-2-butene-1,4-dione
OPENEYE Name: (E)-1,4-bis(1-piperidyl)but-2-ene-1,4-dione
IUPAC Name: (E)-1,4-di(piperidin-1-yl)but-2-ene-1,4-dione
SYSTEMATIC NAME: (E)-1,4-di(piperidin-1-yl)but-2-ene-1,4-dione
MOLECULAR FORMULA: C14H22N2O2
MOLECULAR WEIGHT: 250.33668
SMILES: C1CCN(CC1)C(=O)/C=C/C(=O)N2CCCCC2
Structure:
CAS RN: 19698-44-3
CAS Name: 2-[[(E)-but-2-enyl]thio]benzoic acid
OPENEYE Name: 2-[(E)-but-2-enyl]sulfanylbenzoic acid
IUPAC Name: 2-[(E)-but-2-enyl]sulfanylbenzoic acid
SYSTEMATIC NAME: 2-[(E)-but-2-enyl]sulfanylbenzoic acid
MOLECULAR FORMULA: C11H12O2S
MOLECULAR WEIGHT: 208.27678
SMILES: C/C=C/CSC1=CC=CC=C1C(=O)O
Structure:
CAS RN: 4666-80-2
CAS Name: 2-[7-(dihydroxymethylidene)-5,6-dioxo-1-cyclohepta-1,3-dienyl]acetic acid
OPENEYE Name: 2-[7-(dihydroxymethylene)-5,6-dioxo-cyclohepta-1,3-dien-1-yl]acetic acid
IUPAC Name: 2-[7-(dihydroxymethylidene)-5,6-dioxocyclohepta-1,3-dien-1-yl]acetic acid
SYSTEMATIC NAME: 2-[7-[bis(oxidanyl)methylidene]-5,6-bis(oxidanylidene)cyclohepta-1,3-dien-1-yl]ethanoic acid
MOLECULAR FORMULA: C10H8O6
MOLECULAR WEIGHT: 224.16692
SMILES: C1=CC(=O)C(=O)C(=C(O)O)C(=C1)CC(=O)O
Structure:
CAS RN: 1733-37-5
CAS Name: (2Z,4E)-hexa-2,4-dienedioic acid dimethyl ester
OPENEYE Name: dimethyl (2Z,4E)-hexa-2,4-dienedioate
IUPAC Name: dimethyl (2Z,4E)-hexa-2,4-dienedioate
SYSTEMATIC NAME: dimethyl (2Z,4E)-hexa-2,4-dienedioate
MOLECULAR FORMULA: C8H10O4
MOLECULAR WEIGHT: 170.1626
SMILES: COC(=O)/C=C/C=C\C(=O)OC
Structure:
CAS RN: 788-24-9
CAS Name: 4-[(6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]benzoic acid
OPENEYE Name: 4-[(6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]benzoic acid
IUPAC Name: 4-[(6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]benzoic acid
SYSTEMATIC NAME: 4-[(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methylamino]benzoic acid
MOLECULAR FORMULA: C14H11NO3
MOLECULAR WEIGHT: 241.24204
SMILES: C1=CC(=CNC2=CC=C(C=C2)C(=O)O)C(=O)C=C1
Structure:
CAS RN: 3290-98-0
CAS Name: 6-[(2-methoxyanilino)methylidene]-1-cyclohexa-2,4-dienone
OPENEYE Name: 6-[(2-methoxyanilino)methylene]cyclohexa-2,4-dien-1-one
IUPAC Name: 6-[(2-methoxyanilino)methylidene]cyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: 6-[[(2-methoxyphenyl)amino]methylidene]cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C14H13NO2
MOLECULAR WEIGHT: 227.25852
SMILES: COC1=CC=CC=C1NC=C2C=CC=CC2=O
Structure:
CAS RN: 3246-73-9
CAS Name: 6-[(2-methylanilino)methylidene]-1-cyclohexa-2,4-dienone
OPENEYE Name: 6-[(2-methylanilino)methylene]cyclohexa-2,4-dien-1-one
IUPAC Name: 6-[(2-methylanilino)methylidene]cyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: 6-[[(2-methylphenyl)amino]methylidene]cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C14H13NO
MOLECULAR WEIGHT: 211.25912
SMILES: CC1=CC=CC=C1NC=C2C=CC=CC2=O
Structure:
CAS RN: 36265-20-0
CAS Name: 5-[[cyclohexyl(methyl)amino]hydrazinylidene]-4-imidazolecarboxylic acid octyl ester
OPENEYE Name: octyl 5-[[cyclohexyl(methyl)amino]hydrazono]imidazole-4-carboxylate
IUPAC Name: octyl 5-[[cyclohexyl(methyl)amino]hydrazinylidene]imidazole-4-carboxylate
SYSTEMATIC NAME: octyl 5-[[cyclohexyl(methyl)amino]hydrazinylidene]imidazole-4-carboxylate
MOLECULAR FORMULA: C19H33N5O2
MOLECULAR WEIGHT: 363.49762
SMILES: CCCCCCCCOC(=O)C1=NC=NC1=NNN(C)C2CCCCC2
Structure:
CAS RN: 21889-07-6
CAS Name: 4-[(3E)-3-(1-indenylidene)prop-1-enyl]-N,N-dimethylaniline
OPENEYE Name: 4-[(3E)-3-inden-1-ylideneprop-1-enyl]-N,N-dimethyl-aniline
IUPAC Name: 4-[(3E)-3-inden-1-ylideneprop-1-enyl]-N,N-dimethylaniline
SYSTEMATIC NAME: 4-[(3E)-3-inden-1-ylideneprop-1-enyl]-N,N-dimethyl-aniline
MOLECULAR FORMULA: C20H19N
MOLECULAR WEIGHT: 273.37156
SMILES: CN(C)C1=CC=C(C=C1)C=C/C=C/2\C=CC3=CC=CC=C32
Structure:
CAS RN: 14208-80-1
CAS Name: 7-bromo-2-(diacetylamino)-3-hydroxy-4,6-dimethyl-10H-phenoxazine-1,9-dicarboxylic acid dibutyl ester
OPENEYE Name: dibutyl 7-bromo-2-(diacetylamino)-3-hydroxy-4,6-dimethyl-10H-phenoxazine-1,9-dicarboxylate
IUPAC Name: dibutyl 7-bromo-2-(diacetylamino)-3-hydroxy-4,6-dimethyl-10H-phenoxazine-1,9-dicarboxylate
SYSTEMATIC NAME: dibutyl 7-bromanyl-2-(diethanoylamino)-4,6-dimethyl-3-oxidanyl-10H-phenoxazine-1,9-dicarboxylate
MOLECULAR FORMULA: C28H33BrN2O8
MOLECULAR WEIGHT: 605.47422
SMILES: CCCCOC(=O)C1=CC(=C(C2=C1NC3=C(C(=C(C(=C3O2)C)O)N(C(=O)C)C(=O)C)C(=O)OCCCC)C)Br
Structure:
CAS RN: 13229-26-0
CAS Name: 2-(diacetylamino)-3-hydroxy-4,6-dimethyl-10H-phenoxazine-1,9-dicarboxylic acid dibutyl ester
OPENEYE Name: dibutyl 2-(diacetylamino)-3-hydroxy-4,6-dimethyl-10H-phenoxazine-1,9-dicarboxylate
IUPAC Name: dibutyl 2-(diacetylamino)-3-hydroxy-4,6-dimethyl-10H-phenoxazine-1,9-dicarboxylate
SYSTEMATIC NAME: dibutyl 2-(diethanoylamino)-4,6-dimethyl-3-oxidanyl-10H-phenoxazine-1,9-dicarboxylate
MOLECULAR FORMULA: C28H34N2O8
MOLECULAR WEIGHT: 526.57816
SMILES: CCCCOC(=O)C1=C2C(=C(C=C1)C)OC3=C(C(=C(C(=C3N2)C(=O)OCCCC)N(C(=O)C)C(=O)C)O)C
Structure:
CAS RN: 89533-24-4
CAS Name: [[(E)-2-pyrrolylidenemethyl]amino]urea
OPENEYE Name: [[(E)-pyrrol-2-ylidenemethyl]amino]urea
IUPAC Name: [[(E)-pyrrol-2-ylidenemethyl]amino]urea
SYSTEMATIC NAME: 1-[[(E)-pyrrol-2-ylidenemethyl]amino]urea
MOLECULAR FORMULA: C6H8N4O
MOLECULAR WEIGHT: 152.15392
SMILES: C1=C/C(=C\NNC(=O)N)/N=C1
Structure:
CAS RN: 19889-62-4
CAS Name: acetic acid [(Z)-4-nitro-5-(9-phenanthrenyl)pent-4-enyl] ester
OPENEYE Name: [(Z)-4-nitro-5-(9-phenanthryl)pent-4-enyl] acetate
IUPAC Name: [(Z)-4-nitro-5-phenanthren-9-ylpent-4-enyl] acetate
SYSTEMATIC NAME: [(Z)-4-nitro-5-phenanthren-9-yl-pent-4-enyl] ethanoate
MOLECULAR FORMULA: C21H19NO4
MOLECULAR WEIGHT: 349.37986
SMILES: CC(=O)OCCC/C(=C/C1=CC2=CC=CC=C2C3=CC=CC=C31)/[N+](=O)[O-]
Structure:
CAS RN: 31558-18-6
CAS Name: 4,6-dimethyl-2-oxo-1-[(6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-3-pyridinecarbonitrile
OPENEYE Name: 4,6-dimethyl-2-oxo-1-[(6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]pyridine-3-carbonitrile
IUPAC Name: 4,6-dimethyl-2-oxo-1-[(6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]pyridine-3-carbonitrile
SYSTEMATIC NAME: 4,6-dimethyl-2-oxidanylidene-1-[(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methylamino]pyridine-3-carbonitrile
MOLECULAR FORMULA: C15H13N3O2
MOLECULAR WEIGHT: 267.28262
SMILES: CC1=CC(=C(C(=O)N1NC=C2C=CC=CC2=O)C#N)C
Structure:
CAS RN: 1008-65-7
CAS Name: (6Z)-6-(3H-1,3,4-oxadiazol-2-ylidene)-1-cyclohexa-2,4-dienone
OPENEYE Name: (6Z)-6-(3H-1,3,4-oxadiazol-2-ylidene)cyclohexa-2,4-dien-1-one
IUPAC Name: (6Z)-6-(3H-1,3,4-oxadiazol-2-ylidene)cyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: (6Z)-6-(3H-1,3,4-oxadiazol-2-ylidene)cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C8H6N2O2
MOLECULAR WEIGHT: 162.14544
SMILES: C1=C/C(=C/2\NN=CO2)/C(=O)C=C1
Structure:
CAS RN: 959-74-0
CAS Name: 6-[[4-(dimethylamino)anilino]methylidene]-1-cyclohexa-2,4-dienone
OPENEYE Name: 6-[[4-(dimethylamino)anilino]methylene]cyclohexa-2,4-dien-1-one
IUPAC Name: 6-[[4-(dimethylamino)anilino]methylidene]cyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: 6-[[[4-(dimethylamino)phenyl]amino]methylidene]cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C15H16N2O
MOLECULAR WEIGHT: 240.30034
SMILES: CN(C)C1=CC=C(C=C1)NC=C2C=CC=CC2=O
Structure:
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