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

Systemtic Name: N-[(Z)-3-(azepan-1-yl)-3-oxidanylidene-1-(4-propan-2-yloxyphenyl)prop-1-en-2-yl]-2-bromanyl-benzamide Openeye Name: N-[(Z)-1-(azepane-1-carbonyl)-2-(4-isopropoxyphenyl)vinyl]-2-bromo-benzamide CAS Name: N-[(Z)-3-(1-azepanyl)-3-oxo-1-(4-propan-2-yloxyphenyl)prop-1-en-2-yl]-2-bromobenzamide IUPAC Name: N-[(Z)-3-(azepan-1-yl)-3-oxo-1-(4-propan-2-yloxyphenyl)prop-1-en-2-yl]-2-bromobenzamide Traditional Name: N-[(Z)-1-(azepane-1-carbonyl)-2-(4-isopropoxyphenyl)vinyl]-2-bromo-benzamide Formula: C25H29BrN2O3 MolecularWeight: 485.41336

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C=C(C(=O)N2CCCCCC2)NC(=O)C3=CC=CC=C3Br

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)/C=C(/C(=O)N2CCCCCC2)\NC(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C25H29BrN2O3/c1-18(2)31-20-13-11-19(12-14-20)17-23(25(30)28-15-7-3-4-8-16-28)27-24(29)21-9-5-6-10-22(21)26/h5-6,9-14,17-18H,3-4,7-8,15-16H2,1-2H3,(H,27,29)/b23-17-