[(2R)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 3-(2-methoxyphenyl)-1-(phenylmethyl)pyrazole-4-carboxylate

Systemtic Name: [(2R)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 3-(2-methoxyphenyl)-1-(phenylmethyl)pyrazole-4-carboxylate Openeye Name: [(1R)-2-(cyclopropylamino)-1-methyl-2-oxo-ethyl] 1-benzyl-3-(2-methoxyphenyl)pyrazole-4-carboxylate CAS Name: 3-(2-methoxyphenyl)-1-(phenylmethyl)-4-pyrazolecarboxylic acid [(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] 1-benzyl-3-(2-methoxyphenyl)pyrazole-4-carboxylate Traditional Name: 1-benzyl-3-(2-methoxyphenyl)pyrazole-4-carboxylic acid [(1R)-2-(cyclopropylamino)-2-keto-1-methyl-ethyl] ester Formula: C24H25N3O4 MolecularWeight: 419.473

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)OC(=O)C2=CN(N=C2C3=CC=CC=C3OC)CC4=CC=CC=C4

Isomeric SMILES

C[C@H](C(=O)NC1CC1)OC(=O)C2=CN(N=C2C3=CC=CC=C3OC)CC4=CC=CC=C4

InChI

InChI=1S/C24H25N3O4/c1-16(23(28)25-18-12-13-18)31-24(29)20-15-27(14-17-8-4-3-5-9-17)26-22(20)19-10-6-7-11-21(19)30-2/h3-11,15-16,18H,12-14H2,1-2H3,(H,25,28)/t16-/m1/s1