ethyl 1-[[2-(2-methoxyethyl)-1-oxidanylidene-3-phenyl-3,4-dihydroisoquinolin-4-yl]carbonyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[[2-(2-methoxyethyl)-1-oxidanylidene-3-phenyl-3,4-dihydroisoquinolin-4-yl]carbonyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-(2-methoxyethyl)-1-oxo-3-phenyl-3,4-dihydroisoquinoline-4-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[2-(2-methoxyethyl)-1-oxo-3-phenyl-3,4-dihydroisoquinolin-4-yl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(2-methoxyethyl)-1-oxo-3-phenyl-3,4-dihydroisoquinoline-4-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[1-keto-2-(2-methoxyethyl)-3-phenyl-3,4-dihydroisoquinoline-4-carbonyl]nipecotic acid ethyl ester Formula: C27H32N2O5 MolecularWeight: 464.55338

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2C(N(C(=O)C3=CC=CC=C23)CCOC)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2C(N(C(=O)C3=CC=CC=C23)CCOC)C4=CC=CC=C4

InChI

InChI=1S/C27H32N2O5/c1-3-34-27(32)20-12-9-15-28(18-20)26(31)23-21-13-7-8-14-22(21)25(30)29(16-17-33-2)24(23)19-10-5-4-6-11-19/h4-8,10-11,13-14,20,23-24H,3,9,12,15-18H2,1-2H3