1-[(4-tert-butylphenyl)methyl]-5-methoxy-2H-indazol-3-one

Systemtic Name: 1-[(4-tert-butylphenyl)methyl]-5-methoxy-2H-indazol-3-one Openeye Name: 1-[(4-tert-butylphenyl)methyl]-5-methoxy-2H-indazol-3-one CAS Name: 1-[(4-tert-butylphenyl)methyl]-5-methoxy-2H-indazol-3-one IUPAC Name: 1-[(4-tert-butylphenyl)methyl]-5-methoxy-2H-indazol-3-one Traditional Name: 1-(4-tert-butylbenzyl)-5-methoxy-indazolin-3-one Formula: C19H22N2O2 MolecularWeight: 310.39018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)OC)C(=O)N2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)OC)C(=O)N2

InChI

InChI=1S/C19H22N2O2/c1-19(2,3)14-7-5-13(6-8-14)12-21-17-10-9-15(23-4)11-16(17)18(22)20-21/h5-11H,12H2,1-4H3,(H,20,22)