ethyl 2-[5-(4-chlorophenyl)-2-[(4-methoxyphenyl)carbamoyl]-3,4-dihydropyrazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[5-(4-chlorophenyl)-2-[(4-methoxyphenyl)carbamoyl]-3,4-dihydropyrazol-4-yl]ethanoate Openeye Name: ethyl 2-[5-(4-chlorophenyl)-2-[(4-methoxyphenyl)carbamoyl]-3,4-dihydropyrazol-4-yl]acetate CAS Name: 2-[5-(4-chlorophenyl)-2-[(4-methoxyanilino)-oxomethyl]-3,4-dihydropyrazol-4-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-(4-chlorophenyl)-2-[(4-methoxyphenyl)carbamoyl]-3,4-dihydropyrazol-4-yl]acetate Traditional Name: 2-[3-(4-chlorophenyl)-1-[(4-methoxyphenyl)carbamoyl]-2-pyrazolin-4-yl]acetic acid ethyl ester Formula: C21H22ClN3O4 MolecularWeight: 415.87008

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1CN(N=C1C2=CC=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)CC1CN(N=C1C2=CC=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H22ClN3O4/c1-3-29-19(26)12-15-13-25(24-20(15)14-4-6-16(22)7-5-14)21(27)23-17-8-10-18(28-2)11-9-17/h4-11,15H,3,12-13H2,1-2H3,(H,23,27)