N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-(3,4-diethoxyphenyl)carbonyl-benzamide

Systemtic Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-(3,4-diethoxyphenyl)carbonyl-benzamide Openeye Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-(3,4-diethoxybenzoyl)benzamide CAS Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-[(3,4-diethoxyphenyl)-oxomethyl]benzamide IUPAC Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-(3,4-diethoxybenzoyl)benzamide Traditional Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-(3,4-diethoxybenzoyl)benzamide Formula: C27H27NO6 MolecularWeight: 461.50638

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)NC(C)C3=CC4=C(C=C3)OCO4)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)NC(C)C3=CC4=C(C=C3)OCO4)OCC

InChI

InChI=1S/C27H27NO6/c1-4-31-22-13-11-19(15-24(22)32-5-2)26(29)20-8-6-7-9-21(20)27(30)28-17(3)18-10-12-23-25(14-18)34-16-33-23/h6-15,17H,4-5,16H2,1-3H3,(H,28,30)