N-[(3R,4S)-4-(3,4-dimethoxyphenyl)-1-(phenylmethyl)pyrrolidin-3-yl]pyridine-2-carboxamide

Systemtic Name: N-[(3R,4S)-4-(3,4-dimethoxyphenyl)-1-(phenylmethyl)pyrrolidin-3-yl]pyridine-2-carboxamide Openeye Name: N-[(3R,4S)-1-benzyl-4-(3,4-dimethoxyphenyl)pyrrolidin-3-yl]pyridine-2-carboxamide CAS Name: N-[(3R,4S)-4-(3,4-dimethoxyphenyl)-1-(phenylmethyl)-3-pyrrolidinyl]-2-pyridinecarboxamide IUPAC Name: N-[(3R,4S)-1-benzyl-4-(3,4-dimethoxyphenyl)pyrrolidin-3-yl]pyridine-2-carboxamide Traditional Name: N-[(3R,4S)-1-benzyl-4-(3,4-dimethoxyphenyl)pyrrolidin-3-yl]picolinamide Formula: C25H27N3O3 MolecularWeight: 417.50018

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CN(CC2NC(=O)C3=CC=CC=N3)CC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[C@H]2CN(C[C@@H]2NC(=O)C3=CC=CC=N3)CC4=CC=CC=C4)OC

InChI

InChI=1S/C25H27N3O3/c1-30-23-12-11-19(14-24(23)31-2)20-16-28(15-18-8-4-3-5-9-18)17-22(20)27-25(29)21-10-6-7-13-26-21/h3-14,20,22H,15-17H2,1-2H3,(H,27,29)/t20-,22+/m1/s1