3-(1,3-benzodioxol-5-yl)-N-(3-phenylpropyl)-N-(quinolin-3-ylmethyl)propanamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-(3-phenylpropyl)-N-(quinolin-3-ylmethyl)propanamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-(3-phenylpropyl)-N-(3-quinolylmethyl)propanamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-(3-phenylpropyl)-N-(3-quinolinylmethyl)propanamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-(3-phenylpropyl)-N-(quinolin-3-ylmethyl)propanamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-(3-phenylpropyl)-N-(3-quinolylmethyl)propionamide Formula: C29H28N2O3 MolecularWeight: 452.54422

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCC(=O)N(CCCC3=CC=CC=C3)CC4=CC5=CC=CC=C5N=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCC(=O)N(CCCC3=CC=CC=C3)CC4=CC5=CC=CC=C5N=C4

InChI

InChI=1S/C29H28N2O3/c32-29(15-13-23-12-14-27-28(18-23)34-21-33-27)31(16-6-9-22-7-2-1-3-8-22)20-24-17-25-10-4-5-11-26(25)30-19-24/h1-5,7-8,10-12,14,17-19H,6,9,13,15-16,20-21H2