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

Systemtic Name: (E)-N-[2-[(4-methyl-2-oxidanyl-phenyl)amino]-2-oxidanylidene-ethyl]-3-(4-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-[2-(2-hydroxy-4-methyl-anilino)-2-oxo-ethyl]-3-(4-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[2-(2-hydroxy-4-methylanilino)-2-oxoethyl]-3-(4-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-[2-(2-hydroxy-4-methylanilino)-2-oxoethyl]-3-(4-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-[2-(2-hydroxy-4-methyl-anilino)-2-keto-ethyl]-3-(4-nitrophenyl)acrylamide Formula: C18H17N3O5 MolecularWeight: 355.34468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17N3O5/c1-12-2-8-15(16(22)10-12)20-18(24)11-19-17(23)9-5-13-3-6-14(7-4-13)21(25)26/h2-10,22H,11H2,1H3,(H,19,23)(H,20,24)/b9-5+