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

Systemtic Name: 3-[[(E)-2-(furan-2-ylcarbonylamino)-3-(3-nitrophenyl)prop-2-enoyl]amino]propanoic acid Openeye Name: 3-[[(E)-2-(furan-2-carbonylamino)-3-(3-nitrophenyl)prop-2-enoyl]amino]propanoic acid CAS Name: 3-[[(E)-2-[[2-furanyl(oxo)methyl]amino]-3-(3-nitrophenyl)-1-oxoprop-2-enyl]amino]propanoic acid IUPAC Name: 3-[[(E)-2-(furan-2-carbonylamino)-3-(3-nitrophenyl)prop-2-enoyl]amino]propanoic acid Traditional Name: 3-[[(E)-2-(2-furoylamino)-3-(3-nitrophenyl)acryloyl]amino]propionic acid Formula: C17H15N3O7 MolecularWeight: 373.3169

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15N3O7/c21-15(22)6-7-18-16(23)13(19-17(24)14-5-2-8-27-14)10-11-3-1-4-12(9-11)20(25)26/h1-5,8-10H,6-7H2,(H,18,23)(H,19,24)(H,21,22)/b13-10+