ethyl 5-azanyl-1-[4-[(3-chloranyl-4-methoxy-phenyl)carbamoyl]phenyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-azanyl-1-[4-[(3-chloranyl-4-methoxy-phenyl)carbamoyl]phenyl]pyrazole-4-carboxylate Openeye Name: ethyl 5-amino-1-[4-[(3-chloro-4-methoxy-phenyl)carbamoyl]phenyl]pyrazole-4-carboxylate CAS Name: 5-amino-1-[4-[(3-chloro-4-methoxyanilino)-oxomethyl]phenyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-1-[4-[(3-chloro-4-methoxyphenyl)carbamoyl]phenyl]pyrazole-4-carboxylate Traditional Name: 5-amino-1-[4-[(3-chloro-4-methoxy-phenyl)carbamoyl]phenyl]pyrazole-4-carboxylic acid ethyl ester Formula: C20H19ClN4O4 MolecularWeight: 414.84226

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NC3=CC(=C(C=C3)OC)Cl)N

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NC3=CC(=C(C=C3)OC)Cl)N

InChI

InChI=1S/C20H19ClN4O4/c1-3-29-20(27)15-11-23-25(18(15)22)14-7-4-12(5-8-14)19(26)24-13-6-9-17(28-2)16(21)10-13/h4-11H,3,22H2,1-2H3,(H,24,26)