2-(1,3-benzodioxol-5-ylmethylamino)-3-(1H-indol-3-yl)-2-methyl-N-(1-phenylethyl)propanamide

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethylamino)-3-(1H-indol-3-yl)-2-methyl-N-(1-phenylethyl)propanamide Openeye Name: 2-(1,3-benzodioxol-5-ylmethylamino)-3-(1H-indol-3-yl)-2-methyl-N-(1-phenylethyl)propanamide CAS Name: 2-(1,3-benzodioxol-5-ylmethylamino)-3-(1H-indol-3-yl)-2-methyl-N-(1-phenylethyl)propanamide IUPAC Name: 2-(1,3-benzodioxol-5-ylmethylamino)-3-(1H-indol-3-yl)-2-methyl-N-(1-phenylethyl)propanamide Traditional Name: 3-(1H-indol-3-yl)-2-methyl-N-(1-phenylethyl)-2-(piperonylamino)propionamide Formula: C28H29N3O3 MolecularWeight: 455.54816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C(C)(CC2=CNC3=CC=CC=C32)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C(C)(CC2=CNC3=CC=CC=C32)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C28H29N3O3/c1-19(21-8-4-3-5-9-21)31-27(32)28(2,15-22-17-29-24-11-7-6-10-23(22)24)30-16-20-12-13-25-26(14-20)34-18-33-25/h3-14,17,19,29-30H,15-16,18H2,1-2H3,(H,31,32)