3-chloranyl-4-methoxy-5-[[(E)-3-[5-(2-nitrophenyl)furan-2-yl]prop-2-enoyl]amino]benzoate

Systemtic Name: 3-chloranyl-4-methoxy-5-[[(E)-3-[5-(2-nitrophenyl)furan-2-yl]prop-2-enoyl]amino]benzoate Openeye Name: 3-chloro-4-methoxy-5-[[(E)-3-[5-(2-nitrophenyl)-2-furyl]prop-2-enoyl]amino]benzoate CAS Name: 3-chloro-4-methoxy-5-[[(E)-3-[5-(2-nitrophenyl)-2-furanyl]-1-oxoprop-2-enyl]amino]benzoate IUPAC Name: 3-chloro-4-methoxy-5-[[(E)-3-[5-(2-nitrophenyl)furan-2-yl]prop-2-enoyl]amino]benzoate Traditional Name: 3-chloro-4-methoxy-5-[[(E)-3-[5-(2-nitrophenyl)-2-furyl]acryloyl]amino]benzoate Formula: C21H14ClN2O7- MolecularWeight: 441.79806

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1Cl)C(=O)[O-])NC(=O)C=CC2=CC=C(O2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1Cl)C(=O)[O-])NC(=O)/C=C/C2=CC=C(O2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H15ClN2O7/c1-30-20-15(22)10-12(21(26)27)11-16(20)23-19(25)9-7-13-6-8-18(31-13)14-4-2-3-5-17(14)24(28)29/h2-11H,1H3,(H,23,25)(H,26,27)/p-1/b9-7+