(E)-2-(4-chlorophenyl)carbonyl-3-(1-phenylpyrazol-4-yl)prop-2-enenitrile

Systemtic Name: (E)-2-(4-chlorophenyl)carbonyl-3-(1-phenylpyrazol-4-yl)prop-2-enenitrile Openeye Name: (E)-2-(4-chlorobenzoyl)-3-(1-phenylpyrazol-4-yl)prop-2-enenitrile CAS Name: (E)-2-[(4-chlorophenyl)-oxomethyl]-3-(1-phenyl-4-pyrazolyl)-2-propenenitrile IUPAC Name: (E)-2-(4-chlorobenzoyl)-3-(1-phenylpyrazol-4-yl)prop-2-enenitrile Traditional Name: (E)-2-(4-chlorobenzoyl)-3-(1-phenylpyrazol-4-yl)acrylonitrile Formula: C19H12ClN3O MolecularWeight: 333.77108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)C=C(C#N)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)/C=C(\C#N)/C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H12ClN3O/c20-17-8-6-15(7-9-17)19(24)16(11-21)10-14-12-22-23(13-14)18-4-2-1-3-5-18/h1-10,12-13H/b16-10+