3-phenylpropyl 3-cyano-4-oxidanylidene-2-(4-phenylpiperidin-1-yl)quinolizine-1-carboxylate

Systemtic Name: 3-phenylpropyl 3-cyano-4-oxidanylidene-2-(4-phenylpiperidin-1-yl)quinolizine-1-carboxylate Openeye Name: 3-phenylpropyl 3-cyano-4-oxo-2-(4-phenyl-1-piperidyl)quinolizine-1-carboxylate CAS Name: 3-cyano-4-oxo-2-(4-phenyl-1-piperidinyl)-1-quinolizinecarboxylic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 3-cyano-4-oxo-2-(4-phenylpiperidin-1-yl)quinolizine-1-carboxylate Traditional Name: 3-cyano-4-keto-2-(4-phenylpiperidino)quinolizine-1-carboxylic acid 3-phenylpropyl ester Formula: C31H29N3O3 MolecularWeight: 491.58026

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CC=CC=C2)C3=C(C(=O)N4C=CC=CC4=C3C(=O)OCCCC5=CC=CC=C5)C#N

Isomeric SMILES

C1CN(CCC1C2=CC=CC=C2)C3=C(C(=O)N4C=CC=CC4=C3C(=O)OCCCC5=CC=CC=C5)C#N

InChI

InChI=1S/C31H29N3O3/c32-22-26-29(33-19-16-25(17-20-33)24-13-5-2-6-14-24)28(27-15-7-8-18-34(27)30(26)35)31(36)37-21-9-12-23-10-3-1-4-11-23/h1-8,10-11,13-15,18,25H,9,12,16-17,19-21H2