pyridin-3-ylmethyl 5-azanyl-1-(2,2-diethoxyethyl)pyrazole-4-carboxylate

Systemtic Name: pyridin-3-ylmethyl 5-azanyl-1-(2,2-diethoxyethyl)pyrazole-4-carboxylate Openeye Name: 3-pyridylmethyl 5-amino-1-(2,2-diethoxyethyl)pyrazole-4-carboxylate CAS Name: 5-amino-1-(2,2-diethoxyethyl)-4-pyrazolecarboxylic acid 3-pyridinylmethyl ester IUPAC Name: pyridin-3-ylmethyl 5-amino-1-(2,2-diethoxyethyl)pyrazole-4-carboxylate Traditional Name: 5-amino-1-(2,2-diethoxyethyl)pyrazole-4-carboxylic acid 3-pyridylmethyl ester Formula: C16H22N4O4 MolecularWeight: 334.37028

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CN1C(=C(C=N1)C(=O)OCC2=CN=CC=C2)N)OCC

Isomeric SMILES

CCOC(CN1C(=C(C=N1)C(=O)OCC2=CN=CC=C2)N)OCC

InChI

InChI=1S/C16H22N4O4/c1-3-22-14(23-4-2)10-20-15(17)13(9-19-20)16(21)24-11-12-6-5-7-18-8-12/h5-9,14H,3-4,10-11,17H2,1-2H3