(Z)-3-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]-2-(4-nitrophenyl)prop-2-enenitrile

Systemtic Name: (Z)-3-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]-2-(4-nitrophenyl)prop-2-enenitrile Openeye Name: (Z)-3-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)-2-(4-nitrophenyl)prop-2-enenitrile CAS Name: (Z)-3-[5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolyl]-2-(4-nitrophenyl)-2-propenenitrile IUPAC Name: (Z)-3-(1-benzyl-5-chloro-3-methylpyrazol-4-yl)-2-(4-nitrophenyl)prop-2-enenitrile Traditional Name: (Z)-3-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)-2-(4-nitrophenyl)acrylonitrile Formula: C20H15ClN4O2 MolecularWeight: 378.8117

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=C(C#N)C2=CC=C(C=C2)[N+](=O)[O-])Cl)CC3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1/C=C(\C#N)/C2=CC=C(C=C2)[N+](=O)[O-])Cl)CC3=CC=CC=C3

InChI

InChI=1S/C20H15ClN4O2/c1-14-19(20(21)24(23-14)13-15-5-3-2-4-6-15)11-17(12-22)16-7-9-18(10-8-16)25(26)27/h2-11H,13H2,1H3/b17-11+