N-(1,3-benzodioxol-5-ylmethyl)-1-(4-methylphenyl)carbonyl-4-phenyl-pyrrolidine-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-methylphenyl)carbonyl-4-phenyl-pyrrolidine-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-methylbenzoyl)-4-phenyl-pyrrolidine-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(4-methylphenyl)-oxomethyl]-4-phenyl-3-pyrrolidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-methylbenzoyl)-4-phenylpyrrolidine-3-carboxamide Traditional Name: 4-phenyl-N-piperonyl-1-p-toluoyl-pyrrolidine-3-carboxamide Formula: C27H26N2O4 MolecularWeight: 442.50634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CC(C(C2)C(=O)NCC3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CC(C(C2)C(=O)NCC3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

InChI

InChI=1S/C27H26N2O4/c1-18-7-10-21(11-8-18)27(31)29-15-22(20-5-3-2-4-6-20)23(16-29)26(30)28-14-19-9-12-24-25(13-19)33-17-32-24/h2-13,22-23H,14-17H2,1H3,(H,28,30)