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

Systemtic Name: (E)-3-(3,4-dichlorophenyl)-N-[(5-nitro-2-oxidanyl-phenyl)methyl]prop-2-enamide Openeye Name: (E)-3-(3,4-dichlorophenyl)-N-[(2-hydroxy-5-nitro-phenyl)methyl]prop-2-enamide CAS Name: (E)-3-(3,4-dichlorophenyl)-N-[(2-hydroxy-5-nitrophenyl)methyl]-2-propenamide IUPAC Name: (E)-3-(3,4-dichlorophenyl)-N-[(2-hydroxy-5-nitrophenyl)methyl]prop-2-enamide Traditional Name: (E)-3-(3,4-dichlorophenyl)-N-(2-hydroxy-5-nitro-benzyl)acrylamide Formula: C16H12Cl2N2O4 MolecularWeight: 367.18348

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C=CC(=O)NCC2=C(C=CC(=C2)[N+](=O)[O-])O)Cl)Cl

Isomeric SMILES

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

InChI

InChI=1S/C16H12Cl2N2O4/c17-13-4-1-10(7-14(13)18)2-6-16(22)19-9-11-8-12(20(23)24)3-5-15(11)21/h1-8,21H,9H2,(H,19,22)/b6-2+