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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15NO7/c1-23-16-8-4-12(10-15(16)19)5-9-17(20)25-14-6-2-13(3-7-14)11-24-18(21)22/h2-10,19H,11H2,1H3/b9-5+