3-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-3-yl]carbonylamino]-2-(phenylsulfonylamino)propanoic acid

Systemtic Name: 3-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-3-yl]carbonylamino]-2-(phenylsulfonylamino)propanoic acid Openeye Name: 2-(benzenesulfonamido)-3-[(1-tert-butoxycarbonylpiperidine-3-carbonyl)amino]propanoic acid CAS Name: 2-(benzenesulfonamido)-3-[[[1-[(2-methylpropan-2-yl)oxy-oxomethyl]-3-piperidinyl]-oxomethyl]amino]propanoic acid IUPAC Name: 2-(benzenesulfonamido)-3-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carbonyl]amino]propanoic acid Traditional Name: 2-(benzenesulfonamido)-3-[(1-tert-butoxycarbonylnipecotoyl)amino]propionic acid Formula: C20H29N3O7S MolecularWeight: 455.52516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)C(=O)NCC(C(=O)O)NS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)C(=O)NCC(C(=O)O)NS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H29N3O7S/c1-20(2,3)30-19(27)23-11-7-8-14(13-23)17(24)21-12-16(18(25)26)22-31(28,29)15-9-5-4-6-10-15/h4-6,9-10,14,16,22H,7-8,11-13H2,1-3H3,(H,21,24)(H,25,26)