ethyl 1-[(3-cyano-1-methyl-indol-2-yl)methyl]-4-phenyl-piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(3-cyano-1-methyl-indol-2-yl)methyl]-4-phenyl-piperidine-4-carboxylate Openeye Name: ethyl 1-[(3-cyano-1-methyl-indol-2-yl)methyl]-4-phenyl-piperidine-4-carboxylate CAS Name: 1-[(3-cyano-1-methyl-2-indolyl)methyl]-4-phenyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(3-cyano-1-methylindol-2-yl)methyl]-4-phenylpiperidine-4-carboxylate Traditional Name: 1-[(3-cyano-1-methyl-indol-2-yl)methyl]-4-phenyl-isonipecotic acid ethyl ester Formula: C25H27N3O2 MolecularWeight: 401.50078

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)CC2=C(C3=CC=CC=C3N2C)C#N)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)CC2=C(C3=CC=CC=C3N2C)C#N)C4=CC=CC=C4

InChI

InChI=1S/C25H27N3O2/c1-3-30-24(29)25(19-9-5-4-6-10-19)13-15-28(16-14-25)18-23-21(17-26)20-11-7-8-12-22(20)27(23)2/h4-12H,3,13-16,18H2,1-2H3