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

Systemtic Name: 3-[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-oxidanylidene-butanoyl]amino]-N,N-diethyl-benzamide Openeye Name: 3-[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-oxo-butanoyl]amino]-N,N-diethyl-benzamide CAS Name: 3-[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1,4-dioxobutyl]amino]-N,N-diethylbenzamide IUPAC Name: 3-[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-oxobutanoyl]amino]-N,N-diethylbenzamide Traditional Name: 3-[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-keto-butanoyl]amino]-N,N-diethyl-benzamide Formula: C24H28N2O5 MolecularWeight: 424.48952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H28N2O5/c1-3-26(4-2)24(29)18-7-5-8-19(15-18)25-23(28)12-10-20(27)17-9-11-21-22(16-17)31-14-6-13-30-21/h5,7-9,11,15-16H,3-4,6,10,12-14H2,1-2H3,(H,25,28)