tert-butyl N-[[4-[4-(3-hydroxyphenyl)piperazin-1-yl]carbonylcyclohexyl]methyl]carbamate

Systemtic Name: tert-butyl N-[[4-[4-(3-hydroxyphenyl)piperazin-1-yl]carbonylcyclohexyl]methyl]carbamate Openeye Name: tert-butyl N-[[4-[4-(3-hydroxyphenyl)piperazine-1-carbonyl]cyclohexyl]methyl]carbamate CAS Name: N-[[4-[[4-(3-hydroxyphenyl)-1-piperazinyl]-oxomethyl]cyclohexyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[4-[4-(3-hydroxyphenyl)piperazine-1-carbonyl]cyclohexyl]methyl]carbamate Traditional Name: N-[[4-[4-(3-hydroxyphenyl)piperazine-1-carbonyl]cyclohexyl]methyl]carbamic acid tert-butyl ester Formula: C23H35N3O4 MolecularWeight: 417.5417

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1CCC(CC1)C(=O)N2CCN(CC2)C3=CC(=CC=C3)O

Isomeric SMILES

CC(C)(C)OC(=O)NCC1CCC(CC1)C(=O)N2CCN(CC2)C3=CC(=CC=C3)O

InChI

InChI=1S/C23H35N3O4/c1-23(2,3)30-22(29)24-16-17-7-9-18(10-8-17)21(28)26-13-11-25(12-14-26)19-5-4-6-20(27)15-19/h4-6,15,17-18,27H,7-14,16H2,1-3H3,(H,24,29)