2-[[(E)-3-[5-(2-nitrophenyl)furan-2-yl]prop-2-enoyl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[(E)-3-[5-(2-nitrophenyl)furan-2-yl]prop-2-enoyl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[[(E)-3-[5-(2-nitrophenyl)-2-furyl]prop-2-enoyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[(E)-3-[5-(2-nitrophenyl)-2-furanyl]-1-oxoprop-2-enyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[(E)-3-[5-(2-nitrophenyl)furan-2-yl]prop-2-enoyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[(E)-3-[5-(2-nitrophenyl)-2-furyl]acryloyl]amino]-3-phenyl-propionic acid Formula: C22H18N2O6 MolecularWeight: 406.38812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)C=CC2=CC=C(O2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)/C=C/C2=CC=C(O2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C22H18N2O6/c25-21(23-18(22(26)27)14-15-6-2-1-3-7-15)13-11-16-10-12-20(30-16)17-8-4-5-9-19(17)24(28)29/h1-13,18H,14H2,(H,23,25)(H,26,27)/b13-11+