(2R)-N-(4-benzamidocyclohexyl)-1-(1,3-benzodioxol-5-ylcarbonyl)pyrrolidine-2-carboxamide

Systemtic Name: (2R)-N-(4-benzamidocyclohexyl)-1-(1,3-benzodioxol-5-ylcarbonyl)pyrrolidine-2-carboxamide Openeye Name: (2R)-N-(4-benzamidocyclohexyl)-1-(1,3-benzodioxole-5-carbonyl)pyrrolidine-2-carboxamide CAS Name: (2R)-N-(4-benzamidocyclohexyl)-1-[1,3-benzodioxol-5-yl(oxo)methyl]-2-pyrrolidinecarboxamide IUPAC Name: (2R)-N-(4-benzamidocyclohexyl)-1-(1,3-benzodioxole-5-carbonyl)pyrrolidine-2-carboxamide Traditional Name: (2R)-N-(4-benzamidocyclohexyl)-1-piperonyloyl-pyrrolidine-2-carboxamide Formula: C26H29N3O5 MolecularWeight: 463.52556

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC3=C(C=C2)OCO3)C(=O)NC4CCC(CC4)NC(=O)C5=CC=CC=C5

Isomeric SMILES

C1C[C@@H](N(C1)C(=O)C2=CC3=C(C=C2)OCO3)C(=O)NC4CCC(CC4)NC(=O)C5=CC=CC=C5

InChI

InChI=1S/C26H29N3O5/c30-24(17-5-2-1-3-6-17)27-19-9-11-20(12-10-19)28-25(31)21-7-4-14-29(21)26(32)18-8-13-22-23(15-18)34-16-33-22/h1-3,5-6,8,13,15,19-21H,4,7,9-12,14,16H2,(H,27,30)(H,28,31)/t19?,20?,21-/m1/s1