ethyl 2-[4-chloranyl-3,5-bis(3-methoxyphenyl)pyrazol-1-yl]ethanoate

Systemtic Name: ethyl 2-[4-chloranyl-3,5-bis(3-methoxyphenyl)pyrazol-1-yl]ethanoate Openeye Name: ethyl 2-[4-chloro-3,5-bis(3-methoxyphenyl)pyrazol-1-yl]acetate CAS Name: 2-[4-chloro-3,5-bis(3-methoxyphenyl)-1-pyrazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-chloro-3,5-bis(3-methoxyphenyl)pyrazol-1-yl]acetate Traditional Name: 2-[4-chloro-3,5-bis(3-methoxyphenyl)pyrazol-1-yl]acetic acid ethyl ester Formula: C21H21ClN2O4 MolecularWeight: 400.85544

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=C(C(=N1)C2=CC(=CC=C2)OC)Cl)C3=CC(=CC=C3)OC

Isomeric SMILES

CCOC(=O)CN1C(=C(C(=N1)C2=CC(=CC=C2)OC)Cl)C3=CC(=CC=C3)OC

InChI

InChI=1S/C21H21ClN2O4/c1-4-28-18(25)13-24-21(15-8-6-10-17(12-15)27-3)19(22)20(23-24)14-7-5-9-16(11-14)26-2/h5-12H,4,13H2,1-3H3