[4-[1,3-benzodioxol-5-ylsulfonyl(pentan-3-yloxy)amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamic acid

Systemtic Name: [4-[1,3-benzodioxol-5-ylsulfonyl(pentan-3-yloxy)amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamic acid Openeye Name: [3-[1,3-benzodioxol-5-ylsulfonyl(1-ethylpropoxy)amino]-1-benzyl-2-hydroxy-propyl]carbamic acid CAS Name: [4-[1,3-benzodioxol-5-ylsulfonyl(pentan-3-yloxy)amino]-3-hydroxy-1-phenylbutan-2-yl]carbamic acid IUPAC Name: [4-[1,3-benzodioxol-5-ylsulfonyl(pentan-3-yloxy)amino]-3-hydroxy-1-phenylbutan-2-yl]carbamic acid Traditional Name: [3-[1,3-benzodioxol-5-ylsulfonyl(1-ethylpropoxy)amino]-1-benzyl-2-hydroxy-propyl]carbamic acid Formula: C23H30N2O8S MolecularWeight: 494.5579

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)ON(CC(C(CC1=CC=CC=C1)NC(=O)O)O)S(=O)(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCC(CC)ON(CC(C(CC1=CC=CC=C1)NC(=O)O)O)S(=O)(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C23H30N2O8S/c1-3-17(4-2)33-25(34(29,30)18-10-11-21-22(13-18)32-15-31-21)14-20(26)19(24-23(27)28)12-16-8-6-5-7-9-16/h5-11,13,17,19-20,24,26H,3-4,12,14-15H2,1-2H3,(H,27,28)