(E)-2-(4-tert-butylphenyl)carbonyl-3-(2-nitrophenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(4-tert-butylphenyl)carbonyl-3-(2-nitrophenyl)prop-2-enenitrile Openeye Name: (E)-2-(4-tert-butylbenzoyl)-3-(2-nitrophenyl)prop-2-enenitrile CAS Name: (E)-2-[(4-tert-butylphenyl)-oxomethyl]-3-(2-nitrophenyl)-2-propenenitrile IUPAC Name: (E)-2-(4-tert-butylbenzoyl)-3-(2-nitrophenyl)prop-2-enenitrile Traditional Name: (E)-2-(4-tert-butylbenzoyl)-3-(2-nitrophenyl)acrylonitrile Formula: C20H18N2O3 MolecularWeight: 334.36852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)C(=CC2=CC=CC=C2[N+](=O)[O-])C#N

Isomeric SMILES

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

InChI

InChI=1S/C20H18N2O3/c1-20(2,3)17-10-8-14(9-11-17)19(23)16(13-21)12-15-6-4-5-7-18(15)22(24)25/h4-12H,1-3H3/b16-12+