N-[(3S,4R)-4-(2,5-dimethoxyphenyl)-1-(phenylmethyl)pyrrolidin-3-yl]pyridine-2-carboxamide

Systemtic Name: N-[(3S,4R)-4-(2,5-dimethoxyphenyl)-1-(phenylmethyl)pyrrolidin-3-yl]pyridine-2-carboxamide Openeye Name: N-[(3S,4R)-1-benzyl-4-(2,5-dimethoxyphenyl)pyrrolidin-3-yl]pyridine-2-carboxamide CAS Name: N-[(3S,4R)-4-(2,5-dimethoxyphenyl)-1-(phenylmethyl)-3-pyrrolidinyl]-2-pyridinecarboxamide IUPAC Name: N-[(3S,4R)-1-benzyl-4-(2,5-dimethoxyphenyl)pyrrolidin-3-yl]pyridine-2-carboxamide Traditional Name: N-[(3S,4R)-1-benzyl-4-(2,5-dimethoxyphenyl)pyrrolidin-3-yl]picolinamide Formula: C25H27N3O3 MolecularWeight: 417.50018

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H27N3O3/c1-30-19-11-12-24(31-2)20(14-19)21-16-28(15-18-8-4-3-5-9-18)17-23(21)27-25(29)22-10-6-7-13-26-22/h3-14,21,23H,15-17H2,1-2H3,(H,27,29)/t21-,23+/m0/s1