3-[(3-cyclopentyloxy-4-methoxy-phenyl)methylamino]pyrazole-1-carboxylic acid

Systemtic Name: 3-[(3-cyclopentyloxy-4-methoxy-phenyl)methylamino]pyrazole-1-carboxylic acid Openeye Name: 3-[[3-(cyclopentoxy)-4-methoxy-phenyl]methylamino]pyrazole-1-carboxylic acid CAS Name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methylamino]-1-pyrazolecarboxylic acid IUPAC Name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methylamino]pyrazole-1-carboxylic acid Traditional Name: 3-[[3-(cyclopentoxy)-4-methoxy-benzyl]amino]pyrazole-1-carboxylic acid Formula: C17H21N3O4 MolecularWeight: 331.36634

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=NN(C=C2)C(=O)O)OC3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=NN(C=C2)C(=O)O)OC3CCCC3

InChI

InChI=1S/C17H21N3O4/c1-23-14-7-6-12(10-15(14)24-13-4-2-3-5-13)11-18-16-8-9-20(19-16)17(21)22/h6-10,13H,2-5,11H2,1H3,(H,18,19)(H,21,22)