(phenylmethyl) 2-[[(E)-3-(4-chloranyl-3-nitro-phenyl)prop-2-enoyl]amino]ethanoate

Systemtic Name: (phenylmethyl) 2-[[(E)-3-(4-chloranyl-3-nitro-phenyl)prop-2-enoyl]amino]ethanoate Openeye Name: benzyl 2-[[(E)-3-(4-chloro-3-nitro-phenyl)prop-2-enoyl]amino]acetate CAS Name: 2-[[(E)-3-(4-chloro-3-nitrophenyl)-1-oxoprop-2-enyl]amino]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[(E)-3-(4-chloro-3-nitrophenyl)prop-2-enoyl]amino]acetate Traditional Name: 2-[[(E)-3-(4-chloro-3-nitro-phenyl)acryloyl]amino]acetic acid benzyl ester Formula: C18H15ClN2O5 MolecularWeight: 374.7751

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CNC(=O)C=CC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C18H15ClN2O5/c19-15-8-6-13(10-16(15)21(24)25)7-9-17(22)20-11-18(23)26-12-14-4-2-1-3-5-14/h1-10H,11-12H2,(H,20,22)/b9-7+