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

Systemtic Name: N-[(Z)-3-(azepan-1-yl)-1-(4-chlorophenyl)-3-oxidanylidene-prop-1-en-2-yl]-4-bromanyl-benzamide Openeye Name: N-[(Z)-1-(azepane-1-carbonyl)-2-(4-chlorophenyl)vinyl]-4-bromo-benzamide CAS Name: N-[(Z)-3-(1-azepanyl)-1-(4-chlorophenyl)-3-oxoprop-1-en-2-yl]-4-bromobenzamide IUPAC Name: N-[(Z)-3-(azepan-1-yl)-1-(4-chlorophenyl)-3-oxoprop-1-en-2-yl]-4-bromobenzamide Traditional Name: N-[(Z)-1-(azepane-1-carbonyl)-2-(4-chlorophenyl)vinyl]-4-bromo-benzamide Formula: C22H22BrClN2O2 MolecularWeight: 461.77928

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C(=CC2=CC=C(C=C2)Cl)NC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

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

InChI

InChI=1S/C22H22BrClN2O2/c23-18-9-7-17(8-10-18)21(27)25-20(15-16-5-11-19(24)12-6-16)22(28)26-13-3-1-2-4-14-26/h5-12,15H,1-4,13-14H2,(H,25,27)/b20-15-