2-ethyl-4-[(2,3,4-trimethoxyphenyl)methylamino]pyrazole-3-carboxylic acid

Systemtic Name: 2-ethyl-4-[(2,3,4-trimethoxyphenyl)methylamino]pyrazole-3-carboxylic acid Openeye Name: 2-ethyl-4-[(2,3,4-trimethoxyphenyl)methylamino]pyrazole-3-carboxylic acid CAS Name: 2-ethyl-4-[(2,3,4-trimethoxyphenyl)methylamino]-3-pyrazolecarboxylic acid IUPAC Name: 2-ethyl-4-[(2,3,4-trimethoxyphenyl)methylamino]pyrazole-3-carboxylic acid Traditional Name: 2-ethyl-4-[(2,3,4-trimethoxybenzyl)amino]pyrazole-3-carboxylic acid Formula: C16H21N3O5 MolecularWeight: 335.35504

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)NCC2=C(C(=C(C=C2)OC)OC)OC)C(=O)O

Isomeric SMILES

CCN1C(=C(C=N1)NCC2=C(C(=C(C=C2)OC)OC)OC)C(=O)O

InChI

InChI=1S/C16H21N3O5/c1-5-19-13(16(20)21)11(9-18-19)17-8-10-6-7-12(22-2)15(24-4)14(10)23-3/h6-7,9,17H,5,8H2,1-4H3,(H,20,21)