methyl (E)-3-(2-acetamido-3-nitro-phenyl)prop-2-enoate

Systemtic Name: methyl (E)-3-(2-acetamido-3-nitro-phenyl)prop-2-enoate Openeye Name: methyl (E)-3-(2-acetamido-3-nitro-phenyl)prop-2-enoate CAS Name: (E)-3-(2-acetamido-3-nitrophenyl)-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-(2-acetamido-3-nitrophenyl)prop-2-enoate Traditional Name: (E)-3-(2-acetamido-3-nitro-phenyl)acrylic acid methyl ester Formula: C12H12N2O5 MolecularWeight: 264.23408

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC=C1[N+](=O)[O-])C=CC(=O)OC

Isomeric SMILES

CC(=O)NC1=C(C=CC=C1[N+](=O)[O-])/C=C/C(=O)OC

InChI

InChI=1S/C12H12N2O5/c1-8(15)13-12-9(6-7-11(16)19-2)4-3-5-10(12)14(17)18/h3-7H,1-2H3,(H,13,15)/b7-6+