(phenylmethyl) 3-[(5-tert-butyl-2-methyl-pyrazol-3-yl)amino]-3-oxidanylidene-propanoate

Systemtic Name: (phenylmethyl) 3-[(5-tert-butyl-2-methyl-pyrazol-3-yl)amino]-3-oxidanylidene-propanoate Openeye Name: benzyl 3-[(5-tert-butyl-2-methyl-pyrazol-3-yl)amino]-3-oxo-propanoate CAS Name: 3-[(5-tert-butyl-2-methyl-3-pyrazolyl)amino]-3-oxopropanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[(5-tert-butyl-2-methylpyrazol-3-yl)amino]-3-oxopropanoate Traditional Name: 3-[(5-tert-butyl-2-methyl-pyrazol-3-yl)amino]-3-keto-propionic acid benzyl ester Formula: C18H23N3O3 MolecularWeight: 329.39352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)CC(=O)OCC2=CC=CC=C2)C

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)CC(=O)OCC2=CC=CC=C2)C

InChI

InChI=1S/C18H23N3O3/c1-18(2,3)14-10-15(21(4)20-14)19-16(22)11-17(23)24-12-13-8-6-5-7-9-13/h5-10H,11-12H2,1-4H3,(H,19,22)