4-[(E)-3-(3-nitro-4-propan-2-yl-phenyl)prop-2-enoyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-3-(3-nitro-4-propan-2-yl-phenyl)prop-2-enoyl]benzenecarbonitrile Openeye Name: 4-[(E)-3-(4-isopropyl-3-nitro-phenyl)prop-2-enoyl]benzonitrile CAS Name: 4-[(E)-3-(3-nitro-4-propan-2-ylphenyl)-1-oxoprop-2-enyl]benzonitrile IUPAC Name: 4-[(E)-3-(3-nitro-4-propan-2-ylphenyl)prop-2-enoyl]benzonitrile Traditional Name: 4-[(E)-3-(4-isopropyl-3-nitro-phenyl)acryloyl]benzonitrile Formula: C19H16N2O3 MolecularWeight: 320.34194

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16N2O3/c1-13(2)17-9-5-14(11-18(17)21(23)24)6-10-19(22)16-7-3-15(12-20)4-8-16/h3-11,13H,1-2H3/b10-6+