[4-(nitrooxymethyl)phenyl] (E)-3-(3,4-dimethoxyphenyl)prop-2-enoate

Systemtic Name: [4-(nitrooxymethyl)phenyl] (E)-3-(3,4-dimethoxyphenyl)prop-2-enoate Openeye Name: [4-(nitrooxymethyl)phenyl] (E)-3-(3,4-dimethoxyphenyl)prop-2-enoate CAS Name: (E)-3-(3,4-dimethoxyphenyl)-2-propenoic acid [4-(nitrooxymethyl)phenyl] ester IUPAC Name: [4-(nitrooxymethyl)phenyl] (E)-3-(3,4-dimethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3,4-dimethoxyphenyl)acrylic acid [4-(nitrooxymethyl)phenyl] ester Formula: C18H17NO7 MolecularWeight: 359.33008

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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-])OC

Isomeric SMILES

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

InChI

InChI=1S/C18H17NO7/c1-23-16-9-5-13(11-17(16)24-2)6-10-18(20)26-15-7-3-14(4-8-15)12-25-19(21)22/h3-11H,12H2,1-2H3/b10-6+