(E)-2-(3-nitrophenyl)carbonyl-3-(2,3,4-trimethoxyphenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(3-nitrophenyl)carbonyl-3-(2,3,4-trimethoxyphenyl)prop-2-enenitrile Openeye Name: (E)-2-(3-nitrobenzoyl)-3-(2,3,4-trimethoxyphenyl)prop-2-enenitrile CAS Name: (E)-2-[(3-nitrophenyl)-oxomethyl]-3-(2,3,4-trimethoxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-(3-nitrobenzoyl)-3-(2,3,4-trimethoxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-(3-nitrobenzoyl)-3-(2,3,4-trimethoxyphenyl)acrylonitrile Formula: C19H16N2O6 MolecularWeight: 368.34014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16N2O6/c1-25-16-8-7-13(18(26-2)19(16)27-3)9-14(11-20)17(22)12-5-4-6-15(10-12)21(23)24/h4-10H,1-3H3/b14-9+