ethyl N-[2-[4-[3-(4-aminocarbonylpiperazin-1-yl)-2-oxidanyl-propoxy]-3-tert-butyl-phenyl]ethyl]carbamate

Systemtic Name: ethyl N-[2-[4-[3-(4-aminocarbonylpiperazin-1-yl)-2-oxidanyl-propoxy]-3-tert-butyl-phenyl]ethyl]carbamate Openeye Name: ethyl N-[2-[3-tert-butyl-4-[3-(4-carbamoylpiperazin-1-yl)-2-hydroxy-propoxy]phenyl]ethyl]carbamate CAS Name: N-[2-[3-tert-butyl-4-[3-(4-carbamoyl-1-piperazinyl)-2-hydroxypropoxy]phenyl]ethyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[2-[3-tert-butyl-4-[3-(4-carbamoylpiperazin-1-yl)-2-hydroxypropoxy]phenyl]ethyl]carbamate Traditional Name: N-[2-[3-tert-butyl-4-[3-(4-carbamoylpiperazino)-2-hydroxy-propoxy]phenyl]ethyl]carbamic acid ethyl ester Formula: C23H38N4O5 MolecularWeight: 450.57162

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NCCC1=CC(=C(C=C1)OCC(CN2CCN(CC2)C(=O)N)O)C(C)(C)C

Isomeric SMILES

CCOC(=O)NCCC1=CC(=C(C=C1)OCC(CN2CCN(CC2)C(=O)N)O)C(C)(C)C

InChI

InChI=1S/C23H38N4O5/c1-5-31-22(30)25-9-8-17-6-7-20(19(14-17)23(2,3)4)32-16-18(28)15-26-10-12-27(13-11-26)21(24)29/h6-7,14,18,28H,5,8-13,15-16H2,1-4H3,(H2,24,29)(H,25,30)