2-azanyl-1-[3-azanyl-4-(4-methylsulfonylphenyl)-2-oxidanyl-butanoyl]cyclobutane-1-carboxylic acid

Systemtic Name: 2-azanyl-1-[3-azanyl-4-(4-methylsulfonylphenyl)-2-oxidanyl-butanoyl]cyclobutane-1-carboxylic acid Openeye Name: 2-amino-1-[3-amino-2-hydroxy-4-(4-methylsulfonylphenyl)butanoyl]cyclobutanecarboxylic acid CAS Name: 2-amino-1-[3-amino-2-hydroxy-4-(4-methylsulfonylphenyl)-1-oxobutyl]-1-cyclobutanecarboxylic acid IUPAC Name: 2-amino-1-[3-amino-2-hydroxy-4-(4-methylsulfonylphenyl)butanoyl]cyclobutane-1-carboxylic acid Traditional Name: 2-amino-1-[3-amino-2-hydroxy-4-(4-mesylphenyl)butanoyl]cyclobutanecarboxylic acid Formula: C16H22N2O6S MolecularWeight: 370.42068

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)CC(C(C(=O)C2(CCC2N)C(=O)O)O)N

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)CC(C(C(=O)C2(CCC2N)C(=O)O)O)N

InChI

InChI=1S/C16H22N2O6S/c1-25(23,24)10-4-2-9(3-5-10)8-11(17)13(19)14(20)16(15(21)22)7-6-12(16)18/h2-5,11-13,19H,6-8,17-18H2,1H3,(H,21,22)