methyl 1-(1H-indol-3-ylmethyl)-4-[phenyl(propanoyl)amino]piperidine-4-carboxylate

Systemtic Name: methyl 1-(1H-indol-3-ylmethyl)-4-[phenyl(propanoyl)amino]piperidine-4-carboxylate Openeye Name: methyl 1-(1H-indol-3-ylmethyl)-4-(N-propanoylanilino)piperidine-4-carboxylate CAS Name: 1-(1H-indol-3-ylmethyl)-4-[N-(1-oxopropyl)anilino]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(1H-indol-3-ylmethyl)-4-(N-propanoylanilino)piperidine-4-carboxylate Traditional Name: 1-(1H-indol-3-ylmethyl)-4-(N-propionylanilino)isonipecotic acid methyl ester Formula: C25H29N3O3 MolecularWeight: 419.51606

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2)CC3=CNC4=CC=CC=C43)C(=O)OC

Isomeric SMILES

CCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2)CC3=CNC4=CC=CC=C43)C(=O)OC

InChI

InChI=1S/C25H29N3O3/c1-3-23(29)28(20-9-5-4-6-10-20)25(24(30)31-2)13-15-27(16-14-25)18-19-17-26-22-12-8-7-11-21(19)22/h4-12,17,26H,3,13-16,18H2,1-2H3