[2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl] 2-methyl-1-oxidanylidene-4-phenyl-isoquinoline-3-carboxylate

Systemtic Name: [2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl] 2-methyl-1-oxidanylidene-4-phenyl-isoquinoline-3-carboxylate Openeye Name: [2-(3,5-dimethyl-1-piperidyl)-2-oxo-ethyl] 2-methyl-1-oxo-4-phenyl-isoquinoline-3-carboxylate CAS Name: 2-methyl-1-oxo-4-phenyl-3-isoquinolinecarboxylic acid [2-(3,5-dimethyl-1-piperidinyl)-2-oxoethyl] ester IUPAC Name: [2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl] 2-methyl-1-oxo-4-phenylisoquinoline-3-carboxylate Traditional Name: 1-keto-2-methyl-4-phenyl-isoquinoline-3-carboxylic acid [2-(3,5-dimethylpiperidino)-2-keto-ethyl] ester Formula: C26H28N2O4 MolecularWeight: 432.51152

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)COC(=O)C2=C(C3=CC=CC=C3C(=O)N2C)C4=CC=CC=C4)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)COC(=O)C2=C(C3=CC=CC=C3C(=O)N2C)C4=CC=CC=C4)C

InChI

InChI=1S/C26H28N2O4/c1-17-13-18(2)15-28(14-17)22(29)16-32-26(31)24-23(19-9-5-4-6-10-19)20-11-7-8-12-21(20)25(30)27(24)3/h4-12,17-18H,13-16H2,1-3H3