dimethyl 4-[(2-propoxyphenyl)carbonylamino]-1-(pyridin-2-ylmethyl)pyrazole-3,5-dicarboxylate

Systemtic Name: dimethyl 4-[(2-propoxyphenyl)carbonylamino]-1-(pyridin-2-ylmethyl)pyrazole-3,5-dicarboxylate Openeye Name: dimethyl 4-[(2-propoxybenzoyl)amino]-1-(2-pyridylmethyl)pyrazole-3,5-dicarboxylate CAS Name: 4-[[oxo-(2-propoxyphenyl)methyl]amino]-1-(2-pyridinylmethyl)pyrazole-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-[(2-propoxybenzoyl)amino]-1-(pyridin-2-ylmethyl)pyrazole-3,5-dicarboxylate Traditional Name: 4-[(2-propoxybenzoyl)amino]-1-(2-pyridylmethyl)pyrazole-3,5-dicarboxylic acid dimethyl ester Formula: C23H24N4O6 MolecularWeight: 452.45986

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C(=O)NC2=C(N(N=C2C(=O)OC)CC3=CC=CC=N3)C(=O)OC

Isomeric SMILES

CCCOC1=CC=CC=C1C(=O)NC2=C(N(N=C2C(=O)OC)CC3=CC=CC=N3)C(=O)OC

InChI

InChI=1S/C23H24N4O6/c1-4-13-33-17-11-6-5-10-16(17)21(28)25-18-19(22(29)31-2)26-27(20(18)23(30)32-3)14-15-9-7-8-12-24-15/h5-12H,4,13-14H2,1-3H3,(H,25,28)