methyl (6Z)-2-azanyl-6-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-4-(1-phenylmethoxycarbonylpiperidin-3-yl)-1H-pyridine-3-carboxylate

Systemtic Name: methyl (6Z)-2-azanyl-6-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-4-(1-phenylmethoxycarbonylpiperidin-3-yl)-1H-pyridine-3-carboxylate Openeye Name: methyl (6Z)-2-amino-4-(1-benzyloxycarbonyl-3-piperidyl)-6-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-pyridine-3-carboxylate CAS Name: (6Z)-2-amino-6-(6-oxo-1-cyclohexa-2,4-dienylidene)-4-(1-phenylmethoxycarbonyl-3-piperidinyl)-1H-pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl (6Z)-2-amino-6-(6-oxocyclohexa-2,4-dien-1-ylidene)-4-(1-phenylmethoxycarbonylpiperidin-3-yl)-1H-pyridine-3-carboxylate Traditional Name: (6Z)-2-amino-4-(1-carbobenzoxy-3-piperidyl)-6-(6-ketocyclohexa-2,4-dien-1-ylidene)-1H-pyridine-3-carboxylic acid methyl ester Formula: C26H27N3O5 MolecularWeight: 461.50968

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(NC(=C2C=CC=CC2=O)C=C1C3CCCN(C3)C(=O)OCC4=CC=CC=C4)N

Isomeric SMILES

COC(=O)C1=C(N/C(=C\2/C=CC=CC2=O)/C=C1C3CCCN(C3)C(=O)OCC4=CC=CC=C4)N

InChI

InChI=1S/C26H27N3O5/c1-33-25(31)23-20(14-21(28-24(23)27)19-11-5-6-12-22(19)30)18-10-7-13-29(15-18)26(32)34-16-17-8-3-2-4-9-17/h2-6,8-9,11-12,14,18,28H,7,10,13,15-16,27H2,1H3/b21-19-