[4-(phenylcarbamoyl)phenyl]methyl (E)-3-(4-chloranyl-3-nitro-phenyl)prop-2-enoate

Systemtic Name: [4-(phenylcarbamoyl)phenyl]methyl (E)-3-(4-chloranyl-3-nitro-phenyl)prop-2-enoate Openeye Name: [4-(phenylcarbamoyl)phenyl]methyl (E)-3-(4-chloro-3-nitro-phenyl)prop-2-enoate CAS Name: (E)-3-(4-chloro-3-nitrophenyl)-2-propenoic acid [4-[anilino(oxo)methyl]phenyl]methyl ester IUPAC Name: [4-(phenylcarbamoyl)phenyl]methyl (E)-3-(4-chloro-3-nitrophenyl)prop-2-enoate Traditional Name: (E)-3-(4-chloro-3-nitro-phenyl)acrylic acid [4-(phenylcarbamoyl)benzyl] ester Formula: C23H17ClN2O5 MolecularWeight: 436.84448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)COC(=O)C=CC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)COC(=O)/C=C/C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C23H17ClN2O5/c24-20-12-8-16(14-21(20)26(29)30)9-13-22(27)31-15-17-6-10-18(11-7-17)23(28)25-19-4-2-1-3-5-19/h1-14H,15H2,(H,25,28)/b13-9+