(E)-3-(3-chloranyl-4-methyl-phenyl)-N-[(5-nitro-2-oxidanyl-phenyl)methyl]prop-2-enamide

Systemtic Name: (E)-3-(3-chloranyl-4-methyl-phenyl)-N-[(5-nitro-2-oxidanyl-phenyl)methyl]prop-2-enamide Openeye Name: (E)-3-(3-chloro-4-methyl-phenyl)-N-[(2-hydroxy-5-nitro-phenyl)methyl]prop-2-enamide CAS Name: (E)-3-(3-chloro-4-methylphenyl)-N-[(2-hydroxy-5-nitrophenyl)methyl]-2-propenamide IUPAC Name: (E)-3-(3-chloro-4-methylphenyl)-N-[(2-hydroxy-5-nitrophenyl)methyl]prop-2-enamide Traditional Name: (E)-3-(3-chloro-4-methyl-phenyl)-N-(2-hydroxy-5-nitro-benzyl)acrylamide Formula: C17H15ClN2O4 MolecularWeight: 346.765

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15ClN2O4/c1-11-2-3-12(8-15(11)18)4-7-17(22)19-10-13-9-14(20(23)24)5-6-16(13)21/h2-9,21H,10H2,1H3,(H,19,22)/b7-4+