N-(1,3-benzodioxol-5-ylmethyl)-3-(7-ethyl-1H-indol-3-yl)-3-(3-phenoxyphenyl)propanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(7-ethyl-1H-indol-3-yl)-3-(3-phenoxyphenyl)propanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(7-ethyl-1H-indol-3-yl)-3-(3-phenoxyphenyl)propanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(7-ethyl-1H-indol-3-yl)-3-(3-phenoxyphenyl)propanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(7-ethyl-1H-indol-3-yl)-3-(3-phenoxyphenyl)propanamide Traditional Name: 3-(7-ethyl-1H-indol-3-yl)-3-(3-phenoxyphenyl)-N-piperonyl-propionamide Formula: C33H30N2O4 MolecularWeight: 518.6023

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(CC(=O)NCC3=CC4=C(C=C3)OCO4)C5=CC(=CC=C5)OC6=CC=CC=C6

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2C(CC(=O)NCC3=CC4=C(C=C3)OCO4)C5=CC(=CC=C5)OC6=CC=CC=C6

InChI

InChI=1S/C33H30N2O4/c1-2-23-8-7-13-27-29(20-35-33(23)27)28(24-9-6-12-26(17-24)39-25-10-4-3-5-11-25)18-32(36)34-19-22-14-15-30-31(16-22)38-21-37-30/h3-17,20,28,35H,2,18-19,21H2,1H3,(H,34,36)