methyl 6-[1-(1H-imidazol-5-yl)-3-methyl-1-oxidanyl-butyl]naphthalene-2-carboxylate

Systemtic Name: methyl 6-[1-(1H-imidazol-5-yl)-3-methyl-1-oxidanyl-butyl]naphthalene-2-carboxylate Openeye Name: methyl 6-[1-hydroxy-1-(1H-imidazol-5-yl)-3-methyl-butyl]naphthalene-2-carboxylate CAS Name: 6-[1-hydroxy-1-(1H-imidazol-5-yl)-3-methylbutyl]-2-naphthalenecarboxylic acid methyl ester IUPAC Name: methyl 6-[1-hydroxy-1-(1H-imidazol-5-yl)-3-methylbutyl]naphthalene-2-carboxylate Traditional Name: 6-[1-hydroxy-1-(1H-imidazol-5-yl)-3-methyl-butyl]naphthalene-2-carboxylic acid methyl ester Formula: C20H22N2O3 MolecularWeight: 338.40028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC2=C(C=C1)C=C(C=C2)C(=O)OC)(C3=CN=CN3)O

Isomeric SMILES

CC(C)CC(C1=CC2=C(C=C1)C=C(C=C2)C(=O)OC)(C3=CN=CN3)O

InChI

InChI=1S/C20H22N2O3/c1-13(2)10-20(24,18-11-21-12-22-18)17-7-6-14-8-16(19(23)25-3)5-4-15(14)9-17/h4-9,11-13,24H,10H2,1-3H3,(H,21,22)