4-[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-oxidanylidene-butanoyl]amino]-N-methyl-benzamide

Systemtic Name: 4-[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-oxidanylidene-butanoyl]amino]-N-methyl-benzamide Openeye Name: 4-[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-oxo-butanoyl]amino]-N-methyl-benzamide CAS Name: 4-[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1,4-dioxobutyl]amino]-N-methylbenzamide IUPAC Name: 4-[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-oxobutanoyl]amino]-N-methylbenzamide Traditional Name: 4-[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-keto-butanoyl]amino]-N-methyl-benzamide Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)NC(=O)CCC(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)NC(=O)CCC(=O)C2=CC3=C(C=C2)OCCCO3

InChI

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