methyl 1-[[4-[(4-tert-butylphenyl)methoxy]-2H-indazol-3-yl]methyl]-4-oxidanylidene-piperidine-3-carboxylate

Systemtic Name: methyl 1-[[4-[(4-tert-butylphenyl)methoxy]-2H-indazol-3-yl]methyl]-4-oxidanylidene-piperidine-3-carboxylate Openeye Name: methyl 1-[[4-[(4-tert-butylphenyl)methoxy]-2H-indazol-3-yl]methyl]-4-oxo-piperidine-3-carboxylate CAS Name: 1-[[4-[(4-tert-butylphenyl)methoxy]-2H-indazol-3-yl]methyl]-4-oxo-3-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[[4-[(4-tert-butylphenyl)methoxy]-2H-indazol-3-yl]methyl]-4-oxopiperidine-3-carboxylate Traditional Name: 1-[[4-(4-tert-butylbenzyl)oxy-2H-indazol-3-yl]methyl]-4-keto-nipecotic acid methyl ester Formula: C26H31N3O4 MolecularWeight: 449.54204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)COC2=CC=CC3=NNC(=C32)CN4CCC(=O)C(C4)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)COC2=CC=CC3=NNC(=C32)CN4CCC(=O)C(C4)C(=O)OC

InChI

InChI=1S/C26H31N3O4/c1-26(2,3)18-10-8-17(9-11-18)16-33-23-7-5-6-20-24(23)21(28-27-20)15-29-13-12-22(30)19(14-29)25(31)32-4/h5-11,19H,12-16H2,1-4H3,(H,27,28)