(3R,4S)-N-cyclopropyl-N-[[1-(3-methoxypropyl)indol-3-yl]methyl]-4-phenyl-piperidine-3-carboxamide

Systemtic Name: (3R,4S)-N-cyclopropyl-N-[[1-(3-methoxypropyl)indol-3-yl]methyl]-4-phenyl-piperidine-3-carboxamide Openeye Name: (3R,4S)-N-cyclopropyl-N-[[1-(3-methoxypropyl)indol-3-yl]methyl]-4-phenyl-piperidine-3-carboxamide CAS Name: (3R,4S)-N-cyclopropyl-N-[[1-(3-methoxypropyl)-3-indolyl]methyl]-4-phenyl-3-piperidinecarboxamide IUPAC Name: (3R,4S)-N-cyclopropyl-N-[[1-(3-methoxypropyl)indol-3-yl]methyl]-4-phenylpiperidine-3-carboxamide Traditional Name: (3R,4S)-N-cyclopropyl-N-[[1-(3-methoxypropyl)indol-3-yl]methyl]-4-phenyl-nipecotamide Formula: C28H35N3O2 MolecularWeight: 445.5964

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C=C(C2=CC=CC=C21)CN(C3CC3)C(=O)C4CNCCC4C5=CC=CC=C5

Isomeric SMILES

COCCCN1C=C(C2=CC=CC=C21)CN(C3CC3)C(=O)[C@H]4CNCC[C@@H]4C5=CC=CC=C5

InChI

InChI=1S/C28H35N3O2/c1-33-17-7-16-30-19-22(25-10-5-6-11-27(25)30)20-31(23-12-13-23)28(32)26-18-29-15-14-24(26)21-8-3-2-4-9-21/h2-6,8-11,19,23-24,26,29H,7,12-18,20H2,1H3/t24-,26+/m1/s1