(3S)-1-[3-(1H-indol-3-yl)propanoyl]-N-[(2R)-4-phenylbutan-2-yl]piperidine-3-carboxamide

Systemtic Name: (3S)-1-[3-(1H-indol-3-yl)propanoyl]-N-[(2R)-4-phenylbutan-2-yl]piperidine-3-carboxamide Openeye Name: (3S)-1-[3-(1H-indol-3-yl)propanoyl]-N-[(1R)-1-methyl-3-phenyl-propyl]piperidine-3-carboxamide CAS Name: (3S)-1-[3-(1H-indol-3-yl)-1-oxopropyl]-N-[(2R)-4-phenylbutan-2-yl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-[3-(1H-indol-3-yl)propanoyl]-N-[(2R)-4-phenylbutan-2-yl]piperidine-3-carboxamide Traditional Name: (3S)-1-[3-(1H-indol-3-yl)propanoyl]-N-[(1R)-1-methyl-3-phenyl-propyl]nipecotamide Formula: C27H33N3O2 MolecularWeight: 431.56982

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)C2CCCN(C2)C(=O)CCC3=CNC4=CC=CC=C43

Isomeric SMILES

C[C@H](CCC1=CC=CC=C1)NC(=O)[C@H]2CCCN(C2)C(=O)CCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C27H33N3O2/c1-20(13-14-21-8-3-2-4-9-21)29-27(32)23-10-7-17-30(19-23)26(31)16-15-22-18-28-25-12-6-5-11-24(22)25/h2-6,8-9,11-12,18,20,23,28H,7,10,13-17,19H2,1H3,(H,29,32)/t20-,23+/m1/s1