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

Systemtic Name: butyl N-[4-[2-oxidanyl-3-(4-propylpiperazin-1-yl)propoxy]phenyl]carbamate hydrochloride Openeye Name: butyl N-[4-[2-hydroxy-3-(4-propylpiperazin-1-yl)propoxy]phenyl]carbamate hydrochloride CAS Name: N-[4-[2-hydroxy-3-(4-propyl-1-piperazinyl)propoxy]phenyl]carbamic acid butyl ester hydrochloride IUPAC Name: butyl N-[4-[2-hydroxy-3-(4-propylpiperazin-1-yl)propoxy]phenyl]carbamate hydrochloride Traditional Name: N-[4-[2-hydroxy-3-(4-propylpiperazino)propoxy]phenyl]carbamic acid butyl ester hydrochloride Formula: C21H36ClN3O4 MolecularWeight: 429.98124

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NC1=CC=C(C=C1)OCC(CN2CCN(CC2)CCC)O.Cl

Isomeric SMILES

CCCCOC(=O)NC1=CC=C(C=C1)OCC(CN2CCN(CC2)CCC)O.Cl

InChI

InChI=1S/C21H35N3O4.ClH/c1-3-5-15-27-21(26)22-18-6-8-20(9-7-18)28-17-19(25)16-24-13-11-23(10-4-2)12-14-24;/h6-9,19,25H,3-5,10-17H2,1-2H3,(H,22,26);1H