(2-acetamido-2-oxidanylidene-ethyl) (E)-3-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]prop-2-enoate

Systemtic Name: (2-acetamido-2-oxidanylidene-ethyl) (E)-3-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]prop-2-enoate Openeye Name: (2-acetamido-2-oxo-ethyl) (E)-3-[3,5-dimethyl-1-(p-tolylmethyl)pyrazol-4-yl]prop-2-enoate CAS Name: (E)-3-[3,5-dimethyl-1-[(4-methylphenyl)methyl]-4-pyrazolyl]-2-propenoic acid (2-acetamido-2-oxoethyl) ester IUPAC Name: (2-acetamido-2-oxoethyl) (E)-3-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]prop-2-enoate Traditional Name: (E)-3-[3,5-dimethyl-1-(4-methylbenzyl)pyrazol-4-yl]acrylic acid (2-acetamido-2-keto-ethyl) ester Formula: C20H23N3O4 MolecularWeight: 369.41432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C=CC(=O)OCC(=O)NC(=O)C)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)/C=C/C(=O)OCC(=O)NC(=O)C)C

InChI

InChI=1S/C20H23N3O4/c1-13-5-7-17(8-6-13)11-23-15(3)18(14(2)22-23)9-10-20(26)27-12-19(25)21-16(4)24/h5-10H,11-12H2,1-4H3,(H,21,24,25)/b10-9+