(phenylmethyl) N-[1-(2-azanyl-1-methylsulfonyl-3-oxidanyl-piperidin-2-yl)-4-methyl-1-oxidanylidene-pentan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-(2-azanyl-1-methylsulfonyl-3-oxidanyl-piperidin-2-yl)-4-methyl-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: benzyl N-[1-(2-amino-3-hydroxy-1-methylsulfonyl-piperidine-2-carbonyl)-3-methyl-butyl]carbamate CAS Name: N-[1-(2-amino-3-hydroxy-1-methylsulfonyl-2-piperidinyl)-4-methyl-1-oxopentan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-(2-amino-3-hydroxy-1-methylsulfonylpiperidin-2-yl)-4-methyl-1-oxopentan-2-yl]carbamate Traditional Name: N-[1-(2-amino-3-hydroxy-1-mesyl-pipecoloyl)-3-methyl-butyl]carbamic acid benzyl ester Formula: C20H31N3O6S MolecularWeight: 441.54164

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)C1(C(CCCN1S(=O)(=O)C)O)N)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(C(=O)C1(C(CCCN1S(=O)(=O)C)O)N)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H31N3O6S/c1-14(2)12-16(22-19(26)29-13-15-8-5-4-6-9-15)18(25)20(21)17(24)10-7-11-23(20)30(3,27)28/h4-6,8-9,14,16-17,24H,7,10-13,21H2,1-3H3,(H,22,26)