2-ethyl-4-[[3-(2-methylpropoxy)phenyl]methylamino]pyrazole-3-carboxylate

Systemtic Name: 2-ethyl-4-[[3-(2-methylpropoxy)phenyl]methylamino]pyrazole-3-carboxylate Openeye Name: 2-ethyl-4-[(3-isobutoxyphenyl)methylamino]pyrazole-3-carboxylate CAS Name: 2-ethyl-4-[[3-(2-methylpropoxy)phenyl]methylamino]-3-pyrazolecarboxylate IUPAC Name: 2-ethyl-4-[[3-(2-methylpropoxy)phenyl]methylamino]pyrazole-3-carboxylate Traditional Name: 2-ethyl-4-[(3-isobutoxybenzyl)amino]pyrazole-3-carboxylate Formula: C17H22N3O3- MolecularWeight: 316.37488

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)NCC2=CC(=CC=C2)OCC(C)C)C(=O)[O-]

Isomeric SMILES

CCN1C(=C(C=N1)NCC2=CC(=CC=C2)OCC(C)C)C(=O)[O-]

InChI

InChI=1S/C17H23N3O3/c1-4-20-16(17(21)22)15(10-19-20)18-9-13-6-5-7-14(8-13)23-11-12(2)3/h5-8,10,12,18H,4,9,11H2,1-3H3,(H,21,22)/p-1