2-[[(E)-2-(furan-2-ylcarbonylamino)-3-(3-nitrophenyl)prop-2-enoyl]amino]ethanoic acid

Systemtic Name: 2-[[(E)-2-(furan-2-ylcarbonylamino)-3-(3-nitrophenyl)prop-2-enoyl]amino]ethanoic acid Openeye Name: 2-[[(E)-2-(furan-2-carbonylamino)-3-(3-nitrophenyl)prop-2-enoyl]amino]acetic acid CAS Name: 2-[[(E)-2-[[2-furanyl(oxo)methyl]amino]-3-(3-nitrophenyl)-1-oxoprop-2-enyl]amino]acetic acid IUPAC Name: 2-[[(E)-2-(furan-2-carbonylamino)-3-(3-nitrophenyl)prop-2-enoyl]amino]acetic acid Traditional Name: 2-[[(E)-2-(2-furoylamino)-3-(3-nitrophenyl)acryloyl]amino]acetic acid Formula: C16H13N3O7 MolecularWeight: 359.29032

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C=C(C(=O)NCC(=O)O)NC(=O)C2=CC=CO2

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])/C=C(\C(=O)NCC(=O)O)/NC(=O)C2=CC=CO2

InChI

InChI=1S/C16H13N3O7/c20-14(21)9-17-15(22)12(18-16(23)13-5-2-6-26-13)8-10-3-1-4-11(7-10)19(24)25/h1-8H,9H2,(H,17,22)(H,18,23)(H,20,21)/b12-8+