N-(1,3-benzodioxol-5-ylmethyl)-3-(1-ethylindol-3-yl)-3-(4-methylphenyl)propanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(1-ethylindol-3-yl)-3-(4-methylphenyl)propanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(1-ethylindol-3-yl)-3-(p-tolyl)propanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(1-ethyl-3-indolyl)-3-(4-methylphenyl)propanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(1-ethylindol-3-yl)-3-(4-methylphenyl)propanamide Traditional Name: 3-(1-ethylindol-3-yl)-N-piperonyl-3-(p-tolyl)propionamide Formula: C28H28N2O3 MolecularWeight: 440.53352

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=CC=CC=C21)C(CC(=O)NCC3=CC4=C(C=C3)OCO4)C5=CC=C(C=C5)C

Isomeric SMILES

CCN1C=C(C2=CC=CC=C21)C(CC(=O)NCC3=CC4=C(C=C3)OCO4)C5=CC=C(C=C5)C

InChI

InChI=1S/C28H28N2O3/c1-3-30-17-24(22-6-4-5-7-25(22)30)23(21-11-8-19(2)9-12-21)15-28(31)29-16-20-10-13-26-27(14-20)33-18-32-26/h4-14,17,23H,3,15-16,18H2,1-2H3,(H,29,31)