[1-[(2-ethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(1-phenylpyrazol-4-yl)propanoate

Systemtic Name: [1-[(2-ethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(1-phenylpyrazol-4-yl)propanoate Openeye Name: [2-(2-ethoxyanilino)-1-methyl-2-oxo-ethyl] 3-(1-phenylpyrazol-4-yl)propanoate CAS Name: 3-(1-phenyl-4-pyrazolyl)propanoic acid [1-(2-ethoxyanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-ethoxyanilino)-1-oxopropan-2-yl] 3-(1-phenylpyrazol-4-yl)propanoate Traditional Name: 3-(1-phenylpyrazol-4-yl)propionic acid [2-keto-1-methyl-2-(o-phenetidino)ethyl] ester Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C(C)OC(=O)CCC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)C(C)OC(=O)CCC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C23H25N3O4/c1-3-29-21-12-8-7-11-20(21)25-23(28)17(2)30-22(27)14-13-18-15-24-26(16-18)19-9-5-4-6-10-19/h4-12,15-17H,3,13-14H2,1-2H3,(H,25,28)