N'-(4-butanoylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)ethanediamide

Systemtic Name: N'-(4-butanoylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)ethanediamide Openeye Name: N'-(4-butanoylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)oxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N'-[4-(1-oxobutyl)phenyl]oxamide IUPAC Name: N'-(4-butanoylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)oxamide Traditional Name: N'-(4-butyrylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)oxamide Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC=C(C=C1)NC(=O)C(=O)NCC2COC3=CC=CC=C3O2

Isomeric SMILES

CCCC(=O)C1=CC=C(C=C1)NC(=O)C(=O)NCC2COC3=CC=CC=C3O2

InChI

InChI=1S/C21H22N2O5/c1-2-5-17(24)14-8-10-15(11-9-14)23-21(26)20(25)22-12-16-13-27-18-6-3-4-7-19(18)28-16/h3-4,6-11,16H,2,5,12-13H2,1H3,(H,22,25)(H,23,26)