tert-butyl N-[4-[1,3-benzodioxol-5-ylsulfonyl(cyclopentyloxy)amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[4-[1,3-benzodioxol-5-ylsulfonyl(cyclopentyloxy)amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate Openeye Name: tert-butyl N-[3-[1,3-benzodioxol-5-ylsulfonyl(cyclopentoxy)amino]-1-benzyl-2-hydroxy-propyl]carbamate CAS Name: N-[4-[1,3-benzodioxol-5-ylsulfonyl(cyclopentyloxy)amino]-3-hydroxy-1-phenylbutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[1,3-benzodioxol-5-ylsulfonyl(cyclopentyloxy)amino]-3-hydroxy-1-phenylbutan-2-yl]carbamate Traditional Name: N-[3-[1,3-benzodioxol-5-ylsulfonyl(cyclopentoxy)amino]-1-benzyl-2-hydroxy-propyl]carbamic acid tert-butyl ester Formula: C27H36N2O8S MolecularWeight: 548.64834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(CN(OC2CCCC2)S(=O)(=O)C3=CC4=C(C=C3)OCO4)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(CN(OC2CCCC2)S(=O)(=O)C3=CC4=C(C=C3)OCO4)O

InChI

InChI=1S/C27H36N2O8S/c1-27(2,3)36-26(31)28-22(15-19-9-5-4-6-10-19)23(30)17-29(37-20-11-7-8-12-20)38(32,33)21-13-14-24-25(16-21)35-18-34-24/h4-6,9-10,13-14,16,20,22-23,30H,7-8,11-12,15,17-18H2,1-3H3,(H,28,31)