(E)-3-(3-methylphenyl)-N-[(5-nitro-2-oxidanyl-phenyl)methyl]prop-2-enamide

Systemtic Name: (E)-3-(3-methylphenyl)-N-[(5-nitro-2-oxidanyl-phenyl)methyl]prop-2-enamide Openeye Name: (E)-N-[(2-hydroxy-5-nitro-phenyl)methyl]-3-(m-tolyl)prop-2-enamide CAS Name: (E)-N-[(2-hydroxy-5-nitrophenyl)methyl]-3-(3-methylphenyl)-2-propenamide IUPAC Name: (E)-N-[(2-hydroxy-5-nitrophenyl)methyl]-3-(3-methylphenyl)prop-2-enamide Traditional Name: (E)-N-(2-hydroxy-5-nitro-benzyl)-3-(m-tolyl)acrylamide Formula: C17H16N2O4 MolecularWeight: 312.31994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C=CC(=O)NCC2=C(C=CC(=C2)[N+](=O)[O-])O

Isomeric SMILES

CC1=CC=CC(=C1)/C=C/C(=O)NCC2=C(C=CC(=C2)[N+](=O)[O-])O

InChI

InChI=1S/C17H16N2O4/c1-12-3-2-4-13(9-12)5-8-17(21)18-11-14-10-15(19(22)23)6-7-16(14)20/h2-10,20H,11H2,1H3,(H,18,21)/b8-5+