1-[(4-cyano-4-phenyl-piperidin-1-yl)methyl]-4-oxidanylidene-quinolizine-3-carboxylic acid

Systemtic Name: 1-[(4-cyano-4-phenyl-piperidin-1-yl)methyl]-4-oxidanylidene-quinolizine-3-carboxylic acid Openeye Name: 1-[(4-cyano-4-phenyl-1-piperidyl)methyl]-4-oxo-quinolizine-3-carboxylic acid CAS Name: 1-[(4-cyano-4-phenyl-1-piperidinyl)methyl]-4-oxo-3-quinolizinecarboxylic acid IUPAC Name: 1-[(4-cyano-4-phenylpiperidin-1-yl)methyl]-4-oxoquinolizine-3-carboxylic acid Traditional Name: 1-[(4-cyano-4-phenyl-piperidino)methyl]-4-keto-quinolizine-3-carboxylic acid Formula: C23H21N3O3 MolecularWeight: 387.43114

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C#N)C2=CC=CC=C2)CC3=C4C=CC=CN4C(=O)C(=C3)C(=O)O

Isomeric SMILES

C1CN(CCC1(C#N)C2=CC=CC=C2)CC3=C4C=CC=CN4C(=O)C(=C3)C(=O)O

InChI

InChI=1S/C23H21N3O3/c24-16-23(18-6-2-1-3-7-18)9-12-25(13-10-23)15-17-14-19(22(28)29)21(27)26-11-5-4-8-20(17)26/h1-8,11,14H,9-10,12-13,15H2,(H,28,29)