(E)-3-[5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]-1-piperidin-1-yl-prop-2-en-1-one

Systemtic Name: (E)-3-[5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]-1-piperidin-1-yl-prop-2-en-1-one Openeye Name: (E)-3-[5-chloro-3-methyl-1-(p-tolylmethyl)pyrazol-4-yl]-1-(1-piperidyl)prop-2-en-1-one CAS Name: (E)-3-[5-chloro-3-methyl-1-[(4-methylphenyl)methyl]-4-pyrazolyl]-1-(1-piperidinyl)-2-propen-1-one IUPAC Name: (E)-3-[5-chloro-3-methyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]-1-piperidin-1-ylprop-2-en-1-one Traditional Name: (E)-3-[5-chloro-3-methyl-1-(4-methylbenzyl)pyrazol-4-yl]-1-piperidino-prop-2-en-1-one Formula: C20H24ClN3O MolecularWeight: 357.87706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C=CC(=O)N3CCCCC3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)/C=C/C(=O)N3CCCCC3)Cl

InChI

InChI=1S/C20H24ClN3O/c1-15-6-8-17(9-7-15)14-24-20(21)18(16(2)22-24)10-11-19(25)23-12-4-3-5-13-23/h6-11H,3-5,12-14H2,1-2H3/b11-10+