(E)-N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-3-(4-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-3-(4-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-3-(4-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-3-(4-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-3-(4-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-3-(4-nitrophenyl)acrylamide Formula: C18H16BrN3O4 MolecularWeight: 418.24134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)C=CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)/C=C/C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H16BrN3O4/c1-12-10-14(19)5-8-16(12)21-18(24)11-20-17(23)9-4-13-2-6-15(7-3-13)22(25)26/h2-10H,11H2,1H3,(H,20,23)(H,21,24)/b9-4+