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

Systemtic Name: ethyl N-[2-[4-[3-(4-aminocarbonylpiperazin-1-yl)-2-oxidanyl-propoxy]-3-propan-2-yl-phenyl]ethyl]carbamate Openeye Name: ethyl N-[2-[4-[3-(4-carbamoylpiperazin-1-yl)-2-hydroxy-propoxy]-3-isopropyl-phenyl]ethyl]carbamate CAS Name: N-[2-[4-[3-(4-carbamoyl-1-piperazinyl)-2-hydroxypropoxy]-3-propan-2-ylphenyl]ethyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[2-[4-[3-(4-carbamoylpiperazin-1-yl)-2-hydroxypropoxy]-3-propan-2-ylphenyl]ethyl]carbamate Traditional Name: N-[2-[4-[3-(4-carbamoylpiperazino)-2-hydroxy-propoxy]-3-isopropyl-phenyl]ethyl]carbamic acid ethyl ester Formula: C22H36N4O5 MolecularWeight: 436.54504

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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

Isomeric SMILES

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

InChI

InChI=1S/C22H36N4O5/c1-4-30-22(29)24-8-7-17-5-6-20(19(13-17)16(2)3)31-15-18(27)14-25-9-11-26(12-10-25)21(23)28/h5-6,13,16,18,27H,4,7-12,14-15H2,1-3H3,(H2,23,28)(H,24,29)