butyl N-[4-[3-[4-(diphenylmethyl)piperazin-1-yl]-2-oxidanyl-propoxy]phenyl]carbamate

Systemtic Name: butyl N-[4-[3-[4-(diphenylmethyl)piperazin-1-yl]-2-oxidanyl-propoxy]phenyl]carbamate Openeye Name: butyl N-[4-[3-(4-benzhydrylpiperazin-1-yl)-2-hydroxy-propoxy]phenyl]carbamate CAS Name: N-[4-[3-[4-(diphenylmethyl)-1-piperazinyl]-2-hydroxypropoxy]phenyl]carbamic acid butyl ester IUPAC Name: butyl N-[4-[3-(4-benzhydrylpiperazin-1-yl)-2-hydroxypropoxy]phenyl]carbamate Traditional Name: N-[4-[3-(4-benzhydrylpiperazino)-2-hydroxy-propoxy]phenyl]carbamic acid butyl ester Formula: C31H39N3O4 MolecularWeight: 517.65906

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NC1=CC=C(C=C1)OCC(CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)O

Isomeric SMILES

CCCCOC(=O)NC1=CC=C(C=C1)OCC(CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)O

InChI

InChI=1S/C31H39N3O4/c1-2-3-22-37-31(36)32-27-14-16-29(17-15-27)38-24-28(35)23-33-18-20-34(21-19-33)30(25-10-6-4-7-11-25)26-12-8-5-9-13-26/h4-17,28,30,35H,2-3,18-24H2,1H3,(H,32,36)