5-azanyl-1-(2,2-diethoxy-1-phenyl-ethyl)pyrazole-4-carboxylic acid

Systemtic Name: 5-azanyl-1-(2,2-diethoxy-1-phenyl-ethyl)pyrazole-4-carboxylic acid Openeye Name: 5-amino-1-(2,2-diethoxy-1-phenyl-ethyl)pyrazole-4-carboxylic acid CAS Name: 5-amino-1-(2,2-diethoxy-1-phenylethyl)-4-pyrazolecarboxylic acid IUPAC Name: 5-amino-1-(2,2-diethoxy-1-phenylethyl)pyrazole-4-carboxylic acid Traditional Name: 5-amino-1-(2,2-diethoxy-1-phenyl-ethyl)pyrazole-4-carboxylic acid Formula: C16H21N3O4 MolecularWeight: 319.35564

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C(C1=CC=CC=C1)N2C(=C(C=N2)C(=O)O)N)OCC

Isomeric SMILES

CCOC(C(C1=CC=CC=C1)N2C(=C(C=N2)C(=O)O)N)OCC

InChI

InChI=1S/C16H21N3O4/c1-3-22-16(23-4-2)13(11-8-6-5-7-9-11)19-14(17)12(10-18-19)15(20)21/h5-10,13,16H,3-4,17H2,1-2H3,(H,20,21)