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

Systemtic Name: N-[(Z)-3-(azepan-1-yl)-1-(4-methoxyphenyl)-3-oxidanylidene-prop-1-en-2-yl]-4-bromanyl-benzamide Openeye Name: N-[(Z)-1-(azepane-1-carbonyl)-2-(4-methoxyphenyl)vinyl]-4-bromo-benzamide CAS Name: N-[(Z)-3-(1-azepanyl)-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl]-4-bromobenzamide IUPAC Name: N-[(Z)-3-(azepan-1-yl)-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl]-4-bromobenzamide Traditional Name: N-[(Z)-1-(azepane-1-carbonyl)-2-(4-methoxyphenyl)vinyl]-4-bromo-benzamide Formula: C23H25BrN2O3 MolecularWeight: 457.3602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=C(C(=O)N2CCCCCC2)NC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

COC1=CC=C(C=C1)/C=C(/C(=O)N2CCCCCC2)\NC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C23H25BrN2O3/c1-29-20-12-6-17(7-13-20)16-21(23(28)26-14-4-2-3-5-15-26)25-22(27)18-8-10-19(24)11-9-18/h6-13,16H,2-5,14-15H2,1H3,(H,25,27)/b21-16-