(E)-N-[4-(azepan-1-yl)phenyl]-3-(3-chlorophenyl)prop-2-enamide

Systemtic Name: (E)-N-[4-(azepan-1-yl)phenyl]-3-(3-chlorophenyl)prop-2-enamide Openeye Name: (E)-N-[4-(azepan-1-yl)phenyl]-3-(3-chlorophenyl)prop-2-enamide CAS Name: (E)-N-[4-(1-azepanyl)phenyl]-3-(3-chlorophenyl)-2-propenamide IUPAC Name: (E)-N-[4-(azepan-1-yl)phenyl]-3-(3-chlorophenyl)prop-2-enamide Traditional Name: (E)-N-[4-(azepan-1-yl)phenyl]-3-(3-chlorophenyl)acrylamide Formula: C21H23ClN2O MolecularWeight: 354.87312

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)C=CC3=CC(=CC=C3)Cl

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)/C=C/C3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H23ClN2O/c22-18-7-5-6-17(16-18)8-13-21(25)23-19-9-11-20(12-10-19)24-14-3-1-2-4-15-24/h5-13,16H,1-4,14-15H2,(H,23,25)/b13-8+