N-[3-(2-bromoethylamino)-1-(3-nitrophenyl)-3-oxidanylidene-prop-1-en-2-yl]benzamide

Systemtic Name: N-[3-(2-bromoethylamino)-1-(3-nitrophenyl)-3-oxidanylidene-prop-1-en-2-yl]benzamide Openeye Name: N-[1-(2-bromoethylcarbamoyl)-2-(3-nitrophenyl)vinyl]benzamide CAS Name: N-[3-(2-bromoethylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide IUPAC Name: N-[3-(2-bromoethylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide Traditional Name: N-[1-(2-bromoethylcarbamoyl)-2-(3-nitrophenyl)vinyl]benzamide Formula: C18H16BrN3O4 MolecularWeight: 418.24134

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(=CC2=CC(=CC=C2)[N+](=O)[O-])C(=O)NCCBr

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC(=CC2=CC(=CC=C2)[N+](=O)[O-])C(=O)NCCBr

InChI

InChI=1S/C18H16BrN3O4/c19-9-10-20-18(24)16(21-17(23)14-6-2-1-3-7-14)12-13-5-4-8-15(11-13)22(25)26/h1-8,11-12H,9-10H2,(H,20,24)(H,21,23)