tert-butyl 4-[4-(1H-imidazol-2-yl)-3-methyl-2-oxidanyl-phenyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(1H-imidazol-2-yl)-3-methyl-2-oxidanyl-phenyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-hydroxy-4-(1H-imidazol-2-yl)-3-methyl-phenyl]piperazine-1-carboxylate CAS Name: 4-[2-hydroxy-4-(1H-imidazol-2-yl)-3-methylphenyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-hydroxy-4-(1H-imidazol-2-yl)-3-methylphenyl]piperazine-1-carboxylate Traditional Name: 4-[2-hydroxy-4-(1H-imidazol-2-yl)-3-methyl-phenyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C19H26N4O3 MolecularWeight: 358.43474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1O)N2CCN(CC2)C(=O)OC(C)(C)C)C3=NC=CN3

Isomeric SMILES

CC1=C(C=CC(=C1O)N2CCN(CC2)C(=O)OC(C)(C)C)C3=NC=CN3

InChI

InChI=1S/C19H26N4O3/c1-13-14(17-20-7-8-21-17)5-6-15(16(13)24)22-9-11-23(12-10-22)18(25)26-19(2,3)4/h5-8,24H,9-12H2,1-4H3,(H,20,21)