N-[(E)-3-(azepan-1-yl)-1-(4-dimethylaminophenyl)-3-oxidanylidene-prop-1-en-2-yl]-2-chloranyl-benzamide

Systemtic Name: N-[(E)-3-(azepan-1-yl)-1-(4-dimethylaminophenyl)-3-oxidanylidene-prop-1-en-2-yl]-2-chloranyl-benzamide Openeye Name: N-[(E)-1-(azepane-1-carbonyl)-2-(4-dimethylaminophenyl)vinyl]-2-chloro-benzamide CAS Name: N-[(E)-3-(1-azepanyl)-1-(4-dimethylaminophenyl)-3-oxoprop-1-en-2-yl]-2-chlorobenzamide IUPAC Name: N-[(E)-3-(azepan-1-yl)-1-(4-dimethylaminophenyl)-3-oxoprop-1-en-2-yl]-2-chlorobenzamide Traditional Name: N-[(E)-1-(azepane-1-carbonyl)-2-(4-dimethylaminophenyl)vinyl]-2-chloro-benzamide Formula: C24H28ClN3O2 MolecularWeight: 425.95102

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C=C(C(=O)N2CCCCCC2)NC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CN(C)C1=CC=C(C=C1)/C=C(\C(=O)N2CCCCCC2)/NC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C24H28ClN3O2/c1-27(2)19-13-11-18(12-14-19)17-22(24(30)28-15-7-3-4-8-16-28)26-23(29)20-9-5-6-10-21(20)25/h5-6,9-14,17H,3-4,7-8,15-16H2,1-2H3,(H,26,29)/b22-17+