ethyl 4-[(1-azanyl-2-phenyl-ethylidene)amino]-1-(4-methoxyphenyl)pyrazole-3-carboxylate hydrochloride

Systemtic Name: ethyl 4-[(1-azanyl-2-phenyl-ethylidene)amino]-1-(4-methoxyphenyl)pyrazole-3-carboxylate hydrochloride Openeye Name: ethyl 4-[(1-amino-2-phenyl-ethylidene)amino]-1-(4-methoxyphenyl)pyrazole-3-carboxylate hydrochloride CAS Name: 4-[(1-amino-2-phenylethylidene)amino]-1-(4-methoxyphenyl)-3-pyrazolecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 4-[(1-amino-2-phenylethylidene)amino]-1-(4-methoxyphenyl)pyrazole-3-carboxylate hydrochloride Traditional Name: 4-[(1-amino-2-phenyl-ethylidene)amino]-1-(4-methoxyphenyl)pyrazole-3-carboxylic acid ethyl ester hydrochloride Formula: C21H23ClN4O3 MolecularWeight: 414.88532

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C=C1N=C(CC2=CC=CC=C2)N)C3=CC=C(C=C3)OC.Cl

Isomeric SMILES

CCOC(=O)C1=NN(C=C1N=C(CC2=CC=CC=C2)N)C3=CC=C(C=C3)OC.Cl

InChI

InChI=1S/C21H22N4O3.ClH/c1-3-28-21(26)20-18(23-19(22)13-15-7-5-4-6-8-15)14-25(24-20)16-9-11-17(27-2)12-10-16;/h4-12,14H,3,13H2,1-2H3,(H2,22,23);1H