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

Systemtic Name: tert-butyl 2-[(4-methyl-3-oxidanyl-phenyl)methyl]piperazine-1-carboxylate Openeye Name: tert-butyl 2-[(3-hydroxy-4-methyl-phenyl)methyl]piperazine-1-carboxylate CAS Name: 2-[(3-hydroxy-4-methylphenyl)methyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(3-hydroxy-4-methylphenyl)methyl]piperazine-1-carboxylate Traditional Name: 2-(3-hydroxy-4-methyl-benzyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C17H26N2O3 MolecularWeight: 306.39994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CC2CNCCN2C(=O)OC(C)(C)C)O

Isomeric SMILES

CC1=C(C=C(C=C1)CC2CNCCN2C(=O)OC(C)(C)C)O

InChI

InChI=1S/C17H26N2O3/c1-12-5-6-13(10-15(12)20)9-14-11-18-7-8-19(14)16(21)22-17(2,3)4/h5-6,10,14,18,20H,7-9,11H2,1-4H3