3-(1,3-benzodioxol-5-yl)-3-(7-ethyl-1H-indol-3-yl)-N-(2-pyridin-2-ylethyl)propanamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-3-(7-ethyl-1H-indol-3-yl)-N-(2-pyridin-2-ylethyl)propanamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-3-(7-ethyl-1H-indol-3-yl)-N-[2-(2-pyridyl)ethyl]propanamide CAS Name: 3-(1,3-benzodioxol-5-yl)-3-(7-ethyl-1H-indol-3-yl)-N-[2-(2-pyridinyl)ethyl]propanamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-3-(7-ethyl-1H-indol-3-yl)-N-(2-pyridin-2-ylethyl)propanamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-3-(7-ethyl-1H-indol-3-yl)-N-[2-(2-pyridyl)ethyl]propionamide Formula: C27H27N3O3 MolecularWeight: 441.52158

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(CC(=O)NCCC3=CC=CC=N3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2C(CC(=O)NCCC3=CC=CC=N3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H27N3O3/c1-2-18-6-5-8-21-23(16-30-27(18)21)22(19-9-10-24-25(14-19)33-17-32-24)15-26(31)29-13-11-20-7-3-4-12-28-20/h3-10,12,14,16,22,30H,2,11,13,15,17H2,1H3,(H,29,31)