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

Systemtic Name: methyl N-[2-[4-[3-(4-aminocarbonylpiperazin-1-yl)-2-oxidanyl-propoxy]-3-methyl-phenyl]ethyl]carbamate Openeye Name: methyl N-[2-[4-[3-(4-carbamoylpiperazin-1-yl)-2-hydroxy-propoxy]-3-methyl-phenyl]ethyl]carbamate CAS Name: N-[2-[4-[3-(4-carbamoyl-1-piperazinyl)-2-hydroxypropoxy]-3-methylphenyl]ethyl]carbamic acid methyl ester IUPAC Name: methyl N-[2-[4-[3-(4-carbamoylpiperazin-1-yl)-2-hydroxypropoxy]-3-methylphenyl]ethyl]carbamate Traditional Name: N-[2-[4-[3-(4-carbamoylpiperazino)-2-hydroxy-propoxy]-3-methyl-phenyl]ethyl]carbamic acid methyl ester Formula: C19H30N4O5 MolecularWeight: 394.4653

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CCNC(=O)OC)OCC(CN2CCN(CC2)C(=O)N)O

Isomeric SMILES

CC1=C(C=CC(=C1)CCNC(=O)OC)OCC(CN2CCN(CC2)C(=O)N)O

InChI

InChI=1S/C19H30N4O5/c1-14-11-15(5-6-21-19(26)27-2)3-4-17(14)28-13-16(24)12-22-7-9-23(10-8-22)18(20)25/h3-4,11,16,24H,5-10,12-13H2,1-2H3,(H2,20,25)(H,21,26)