(E)-2-acetamido-3-[5-(2-chloranyl-4-nitro-phenyl)furan-2-yl]prop-2-enoic acid

Systemtic Name: (E)-2-acetamido-3-[5-(2-chloranyl-4-nitro-phenyl)furan-2-yl]prop-2-enoic acid Openeye Name: (E)-2-acetamido-3-[5-(2-chloro-4-nitro-phenyl)-2-furyl]prop-2-enoic acid CAS Name: (E)-2-acetamido-3-[5-(2-chloro-4-nitrophenyl)-2-furanyl]-2-propenoic acid IUPAC Name: (E)-2-acetamido-3-[5-(2-chloro-4-nitrophenyl)furan-2-yl]prop-2-enoic acid Traditional Name: (E)-2-acetamido-3-[5-(2-chloro-4-nitro-phenyl)-2-furyl]acrylic acid Formula: C15H11ClN2O6 MolecularWeight: 350.71064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(=CC1=CC=C(O1)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C(=O)O

Isomeric SMILES

CC(=O)N/C(=C/C1=CC=C(O1)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)/C(=O)O

InChI

InChI=1S/C15H11ClN2O6/c1-8(19)17-13(15(20)21)7-10-3-5-14(24-10)11-4-2-9(18(22)23)6-12(11)16/h2-7H,1H3,(H,17,19)(H,20,21)/b13-7+