[4-[[(E)-3-(4-methoxy-3-oxidanyl-phenyl)prop-2-enoyl]amino]phenyl]methyl nitrate

Systemtic Name: [4-[[(E)-3-(4-methoxy-3-oxidanyl-phenyl)prop-2-enoyl]amino]phenyl]methyl nitrate Openeye Name: [4-[[(E)-3-(3-hydroxy-4-methoxy-phenyl)prop-2-enoyl]amino]phenyl]methyl nitrate CAS Name: nitric acid [4-[[(E)-3-(3-hydroxy-4-methoxyphenyl)-1-oxoprop-2-enyl]amino]phenyl]methyl ester IUPAC Name: [4-[[(E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoyl]amino]phenyl]methyl nitrate Traditional Name: nitric acid [4-[[(E)-3-(3-hydroxy-4-methoxy-phenyl)acryloyl]amino]benzyl] ester Formula: C17H16N2O6 MolecularWeight: 344.31874

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)NC2=CC=C(C=C2)CO[N+](=O)[O-])O

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)NC2=CC=C(C=C2)CO[N+](=O)[O-])O

InChI

InChI=1S/C17H16N2O6/c1-24-16-8-4-12(10-15(16)20)5-9-17(21)18-14-6-2-13(3-7-14)11-25-19(22)23/h2-10,20H,11H2,1H3,(H,18,21)/b9-5+