3-[4-methoxy-3-[(4-methoxycarbonyl-2-nitro-phenoxy)methyl]phenyl]prop-2-enoic acid

Systemtic Name: 3-[4-methoxy-3-[(4-methoxycarbonyl-2-nitro-phenoxy)methyl]phenyl]prop-2-enoic acid Openeye Name: 3-[4-methoxy-3-[(4-methoxycarbonyl-2-nitro-phenoxy)methyl]phenyl]prop-2-enoic acid CAS Name: 3-[4-methoxy-3-[(4-methoxycarbonyl-2-nitrophenoxy)methyl]phenyl]-2-propenoic acid IUPAC Name: 3-[4-methoxy-3-[(4-methoxycarbonyl-2-nitrophenoxy)methyl]phenyl]prop-2-enoic acid Traditional Name: 3-[3-[(4-carbomethoxy-2-nitro-phenoxy)methyl]-4-methoxy-phenyl]acrylic acid Formula: C19H17NO8 MolecularWeight: 387.34018

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)O)COC2=C(C=C(C=C2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C=CC(=O)O)COC2=C(C=C(C=C2)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C19H17NO8/c1-26-16-6-3-12(4-8-18(21)22)9-14(16)11-28-17-7-5-13(19(23)27-2)10-15(17)20(24)25/h3-10H,11H2,1-2H3,(H,21,22)