N-[3-(azepan-1-yl)-1-(4-ethoxyphenyl)-3-oxidanylidene-prop-1-en-2-yl]-3-bromanyl-benzamide

Systemtic Name: N-[3-(azepan-1-yl)-1-(4-ethoxyphenyl)-3-oxidanylidene-prop-1-en-2-yl]-3-bromanyl-benzamide Openeye Name: N-[1-(azepane-1-carbonyl)-2-(4-ethoxyphenyl)vinyl]-3-bromo-benzamide CAS Name: N-[3-(1-azepanyl)-1-(4-ethoxyphenyl)-3-oxoprop-1-en-2-yl]-3-bromobenzamide IUPAC Name: N-[3-(azepan-1-yl)-1-(4-ethoxyphenyl)-3-oxoprop-1-en-2-yl]-3-bromobenzamide Traditional Name: N-[1-(azepane-1-carbonyl)-2-p-phenetyl-vinyl]-3-bromo-benzamide Formula: C24H27BrN2O3 MolecularWeight: 471.38678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=C(C(=O)N2CCCCCC2)NC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CCOC1=CC=C(C=C1)C=C(C(=O)N2CCCCCC2)NC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C24H27BrN2O3/c1-2-30-21-12-10-18(11-13-21)16-22(24(29)27-14-5-3-4-6-15-27)26-23(28)19-8-7-9-20(25)17-19/h7-13,16-17H,2-6,14-15H2,1H3,(H,26,28)