(3R,4S)-N-cyclopropyl-N-[(2,3-dimethylphenyl)methyl]-4-[3-[[6-(methylamino)pyridin-3-yl]methoxy]phenyl]piperidine-3-carboxamide

Systemtic Name: (3R,4S)-N-cyclopropyl-N-[(2,3-dimethylphenyl)methyl]-4-[3-[[6-(methylamino)pyridin-3-yl]methoxy]phenyl]piperidine-3-carboxamide Openeye Name: (3R,4S)-N-cyclopropyl-N-[(2,3-dimethylphenyl)methyl]-4-[3-[[6-(methylamino)-3-pyridyl]methoxy]phenyl]piperidine-3-carboxamide CAS Name: (3R,4S)-N-cyclopropyl-N-[(2,3-dimethylphenyl)methyl]-4-[3-[[6-(methylamino)-3-pyridinyl]methoxy]phenyl]-3-piperidinecarboxamide IUPAC Name: (3R,4S)-N-cyclopropyl-N-[(2,3-dimethylphenyl)methyl]-4-[3-[[6-(methylamino)pyridin-3-yl]methoxy]phenyl]piperidine-3-carboxamide Traditional Name: (3R,4S)-N-cyclopropyl-N-(2,3-dimethylbenzyl)-4-[3-[[6-(methylamino)-3-pyridyl]methoxy]phenyl]nipecotamide Formula: C31H38N4O2 MolecularWeight: 498.65902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)CN(C2CC2)C(=O)C3CNCCC3C4=CC(=CC=C4)OCC5=CN=C(C=C5)NC)C

Isomeric SMILES

CC1=C(C(=CC=C1)CN(C2CC2)C(=O)[C@H]3CNCC[C@@H]3C4=CC(=CC=C4)OCC5=CN=C(C=C5)NC)C

InChI

InChI=1S/C31H38N4O2/c1-21-6-4-8-25(22(21)2)19-35(26-11-12-26)31(36)29-18-33-15-14-28(29)24-7-5-9-27(16-24)37-20-23-10-13-30(32-3)34-17-23/h4-10,13,16-17,26,28-29,33H,11-12,14-15,18-20H2,1-3H3,(H,32,34)/t28-,29+/m1/s1