3-[[4-(4-bromophenyl)-4-oxidanylidene-butanoyl]amino]-N,N-diethyl-benzamide

Systemtic Name: 3-[[4-(4-bromophenyl)-4-oxidanylidene-butanoyl]amino]-N,N-diethyl-benzamide Openeye Name: 3-[[4-(4-bromophenyl)-4-oxo-butanoyl]amino]-N,N-diethyl-benzamide CAS Name: 3-[[4-(4-bromophenyl)-1,4-dioxobutyl]amino]-N,N-diethylbenzamide IUPAC Name: 3-[[4-(4-bromophenyl)-4-oxobutanoyl]amino]-N,N-diethylbenzamide Traditional Name: 3-[[4-(4-bromophenyl)-4-keto-butanoyl]amino]-N,N-diethyl-benzamide Formula: C21H23BrN2O3 MolecularWeight: 431.32292

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)CCC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)CCC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C21H23BrN2O3/c1-3-24(4-2)21(27)16-6-5-7-18(14-16)23-20(26)13-12-19(25)15-8-10-17(22)11-9-15/h5-11,14H,3-4,12-13H2,1-2H3,(H,23,26)