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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(4-methylphenyl)-1-(4-methylphenyl)carbonyl-pyrrolidine-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-methylbenzoyl)-4-(p-tolyl)pyrrolidine-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(4-methylphenyl)-1-[(4-methylphenyl)-oxomethyl]-3-pyrrolidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-methylbenzoyl)-4-(4-methylphenyl)pyrrolidine-3-carboxamide Traditional Name: N-piperonyl-1-p-toluoyl-4-(p-tolyl)pyrrolidine-3-carboxamide Formula: C28H28N2O4 MolecularWeight: 456.53292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CN(CC2C(=O)NCC3=CC4=C(C=C3)OCO4)C(=O)C5=CC=C(C=C5)C

Isomeric SMILES

CC1=CC=C(C=C1)C2CN(CC2C(=O)NCC3=CC4=C(C=C3)OCO4)C(=O)C5=CC=C(C=C5)C

InChI

InChI=1S/C28H28N2O4/c1-18-3-8-21(9-4-18)23-15-30(28(32)22-10-5-19(2)6-11-22)16-24(23)27(31)29-14-20-7-12-25-26(13-20)34-17-33-25/h3-13,23-24H,14-17H2,1-2H3,(H,29,31)