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

Systemtic Name: methyl 3-[[4-[(4-tert-butylphenyl)methoxy]-2H-indazol-3-yl]methylamino]cyclohexane-1-carboxylate Openeye Name: methyl 3-[[4-[(4-tert-butylphenyl)methoxy]-2H-indazol-3-yl]methylamino]cyclohexanecarboxylate CAS Name: 3-[[4-[(4-tert-butylphenyl)methoxy]-2H-indazol-3-yl]methylamino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 3-[[4-[(4-tert-butylphenyl)methoxy]-2H-indazol-3-yl]methylamino]cyclohexane-1-carboxylate Traditional Name: 3-[[4-(4-tert-butylbenzyl)oxy-2H-indazol-3-yl]methylamino]cyclohexanecarboxylic acid methyl ester Formula: C27H35N3O3 MolecularWeight: 449.5851

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)COC2=CC=CC3=NNC(=C32)CNC4CCCC(C4)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)COC2=CC=CC3=NNC(=C32)CNC4CCCC(C4)C(=O)OC

InChI

InChI=1S/C27H35N3O3/c1-27(2,3)20-13-11-18(12-14-20)17-33-24-10-6-9-22-25(24)23(30-29-22)16-28-21-8-5-7-19(15-21)26(31)32-4/h6,9-14,19,21,28H,5,7-8,15-17H2,1-4H3,(H,29,30)