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

Systemtic Name: 1-methyl-4-[[4-(2-methylpropoxy)phenyl]methylamino]pyrazole-3-carboxylate Openeye Name: 4-[(4-isobutoxyphenyl)methylamino]-1-methyl-pyrazole-3-carboxylate CAS Name: 1-methyl-4-[[4-(2-methylpropoxy)phenyl]methylamino]-3-pyrazolecarboxylate IUPAC Name: 1-methyl-4-[[4-(2-methylpropoxy)phenyl]methylamino]pyrazole-3-carboxylate Traditional Name: 4-[(4-isobutoxybenzyl)amino]-1-methyl-pyrazole-3-carboxylate Formula: C16H20N3O3- MolecularWeight: 302.3483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)CNC2=CN(N=C2C(=O)[O-])C

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)CNC2=CN(N=C2C(=O)[O-])C

InChI

InChI=1S/C16H21N3O3/c1-11(2)10-22-13-6-4-12(5-7-13)8-17-14-9-19(3)18-15(14)16(20)21/h4-7,9,11,17H,8,10H2,1-3H3,(H,20,21)/p-1