(E)-2-(3-nitrophenyl)carbonyl-3-(4-prop-2-ynoxyphenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(3-nitrophenyl)carbonyl-3-(4-prop-2-ynoxyphenyl)prop-2-enenitrile Openeye Name: (E)-2-(3-nitrobenzoyl)-3-(4-prop-2-ynoxyphenyl)prop-2-enenitrile CAS Name: (E)-2-[(3-nitrophenyl)-oxomethyl]-3-(4-prop-2-ynoxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-(3-nitrobenzoyl)-3-(4-prop-2-ynoxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-(3-nitrobenzoyl)-3-(4-propargyloxyphenyl)acrylonitrile Formula: C19H12N2O4 MolecularWeight: 332.30958

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=CC=C(C=C1)C=C(C#N)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C#CCOC1=CC=C(C=C1)/C=C(\C#N)/C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H12N2O4/c1-2-10-25-18-8-6-14(7-9-18)11-16(13-20)19(22)15-4-3-5-17(12-15)21(23)24/h1,3-9,11-12H,10H2/b16-11+