ethyl 3-cyano-4-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]quinolizine-1-carboxylate

Systemtic Name: ethyl 3-cyano-4-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]quinolizine-1-carboxylate Openeye Name: ethyl 2-(4-benzyl-1-piperidyl)-3-cyano-4-oxo-quinolizine-1-carboxylate CAS Name: 3-cyano-4-oxo-2-[4-(phenylmethyl)-1-piperidinyl]-1-quinolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-benzylpiperidin-1-yl)-3-cyano-4-oxoquinolizine-1-carboxylate Traditional Name: 2-(4-benzylpiperidino)-3-cyano-4-keto-quinolizine-1-carboxylic acid ethyl ester Formula: C25H25N3O3 MolecularWeight: 415.4843

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C=CC=CN2C(=O)C(=C1N3CCC(CC3)CC4=CC=CC=C4)C#N

Isomeric SMILES

CCOC(=O)C1=C2C=CC=CN2C(=O)C(=C1N3CCC(CC3)CC4=CC=CC=C4)C#N

InChI

InChI=1S/C25H25N3O3/c1-2-31-25(30)22-21-10-6-7-13-28(21)24(29)20(17-26)23(22)27-14-11-19(12-15-27)16-18-8-4-3-5-9-18/h3-10,13,19H,2,11-12,14-16H2,1H3