(E)-3-[3-[(4-nitrophenyl)carbamoylamino]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[3-[(4-nitrophenyl)carbamoylamino]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[3-[(4-nitrophenyl)carbamoylamino]phenyl]prop-2-enoic acid CAS Name: (E)-3-[3-[[(4-nitroanilino)-oxomethyl]amino]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[3-[(4-nitrophenyl)carbamoylamino]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[3-[(4-nitrophenyl)carbamoylamino]phenyl]acrylic acid Formula: C16H13N3O5 MolecularWeight: 327.29152

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C=CC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])/C=C/C(=O)O

InChI

InChI=1S/C16H13N3O5/c20-15(21)9-4-11-2-1-3-13(10-11)18-16(22)17-12-5-7-14(8-6-12)19(23)24/h1-10H,(H,20,21)(H2,17,18,22)/b9-4+