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

Systemtic Name: N-[(Z)-3-(azepan-1-yl)-3-oxidanylidene-1-phenyl-prop-1-en-2-yl]-3-bromanyl-benzamide Openeye Name: N-[(Z)-1-(azepane-1-carbonyl)-2-phenyl-vinyl]-3-bromo-benzamide CAS Name: N-[(Z)-3-(1-azepanyl)-3-oxo-1-phenylprop-1-en-2-yl]-3-bromobenzamide IUPAC Name: N-[(Z)-3-(azepan-1-yl)-3-oxo-1-phenylprop-1-en-2-yl]-3-bromobenzamide Traditional Name: N-[(Z)-1-(azepane-1-carbonyl)-2-phenyl-vinyl]-3-bromo-benzamide Formula: C22H23BrN2O2 MolecularWeight: 427.33422

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23BrN2O2/c23-19-12-8-11-18(16-19)21(26)24-20(15-17-9-4-3-5-10-17)22(27)25-13-6-1-2-7-14-25/h3-5,8-12,15-16H,1-2,6-7,13-14H2,(H,24,26)/b20-15-