methyl 4-[2-[(4-methoxy-1-phenyl-pyrazol-3-yl)carbonylamino]ethyl]benzoate

Systemtic Name: methyl 4-[2-[(4-methoxy-1-phenyl-pyrazol-3-yl)carbonylamino]ethyl]benzoate Openeye Name: methyl 4-[2-[(4-methoxy-1-phenyl-pyrazole-3-carbonyl)amino]ethyl]benzoate CAS Name: 4-[2-[[(4-methoxy-1-phenyl-3-pyrazolyl)-oxomethyl]amino]ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[(4-methoxy-1-phenylpyrazole-3-carbonyl)amino]ethyl]benzoate Traditional Name: 4-[2-[(4-methoxy-1-phenyl-pyrazole-3-carbonyl)amino]ethyl]benzoic acid methyl ester Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN(N=C1C(=O)NCCC2=CC=C(C=C2)C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

COC1=CN(N=C1C(=O)NCCC2=CC=C(C=C2)C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C21H21N3O4/c1-27-18-14-24(17-6-4-3-5-7-17)23-19(18)20(25)22-13-12-15-8-10-16(11-9-15)21(26)28-2/h3-11,14H,12-13H2,1-2H3,(H,22,25)