[3-(nitrooxymethyl)phenyl] (E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoate

Systemtic Name: [3-(nitrooxymethyl)phenyl] (E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoate Openeye Name: [3-(nitrooxymethyl)phenyl] (E)-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(4-hydroxy-3-methoxyphenyl)-2-propenoic acid [3-(nitrooxymethyl)phenyl] ester IUPAC Name: [3-(nitrooxymethyl)phenyl] (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(4-hydroxy-3-methoxy-phenyl)acrylic acid [3-(nitrooxymethyl)phenyl] ester Formula: C17H15NO7 MolecularWeight: 345.3035

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)OC2=CC=CC(=C2)CO[N+](=O)[O-])O

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)OC2=CC=CC(=C2)CO[N+](=O)[O-])O

InChI

InChI=1S/C17H15NO7/c1-23-16-10-12(5-7-15(16)19)6-8-17(20)25-14-4-2-3-13(9-14)11-24-18(21)22/h2-10,19H,11H2,1H3/b8-6+