N-[(E)-1-(4-bromophenyl)-3-oxidanylidene-3-pyrrolidin-1-yl-prop-1-en-2-yl]-3,4-dimethoxy-benzamide

Systemtic Name: N-[(E)-1-(4-bromophenyl)-3-oxidanylidene-3-pyrrolidin-1-yl-prop-1-en-2-yl]-3,4-dimethoxy-benzamide Openeye Name: N-[(E)-2-(4-bromophenyl)-1-(pyrrolidine-1-carbonyl)vinyl]-3,4-dimethoxy-benzamide CAS Name: N-[(E)-1-(4-bromophenyl)-3-oxo-3-(1-pyrrolidinyl)prop-1-en-2-yl]-3,4-dimethoxybenzamide IUPAC Name: N-[(E)-1-(4-bromophenyl)-3-oxo-3-pyrrolidin-1-ylprop-1-en-2-yl]-3,4-dimethoxybenzamide Traditional Name: N-[(E)-2-(4-bromophenyl)-1-(pyrrolidine-1-carbonyl)vinyl]-3,4-dimethoxy-benzamide Formula: C22H23BrN2O4 MolecularWeight: 459.33302

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=CC2=CC=C(C=C2)Br)C(=O)N3CCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N/C(=C/C2=CC=C(C=C2)Br)/C(=O)N3CCCC3)OC

InChI

InChI=1S/C22H23BrN2O4/c1-28-19-10-7-16(14-20(19)29-2)21(26)24-18(22(27)25-11-3-4-12-25)13-15-5-8-17(23)9-6-15/h5-10,13-14H,3-4,11-12H2,1-2H3,(H,24,26)/b18-13+