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

Systemtic Name: 2-azanyl-1-[3-azanyl-4-(4-methylsulfonylphenyl)-2-oxidanyl-butanoyl]cyclopropane-1-carboxylic acid Openeye Name: 2-amino-1-[3-amino-2-hydroxy-4-(4-methylsulfonylphenyl)butanoyl]cyclopropanecarboxylic acid CAS Name: 2-amino-1-[3-amino-2-hydroxy-4-(4-methylsulfonylphenyl)-1-oxobutyl]-1-cyclopropanecarboxylic acid IUPAC Name: 2-amino-1-[3-amino-2-hydroxy-4-(4-methylsulfonylphenyl)butanoyl]cyclopropane-1-carboxylic acid Traditional Name: 2-amino-1-[3-amino-2-hydroxy-4-(4-mesylphenyl)butanoyl]cyclopropanecarboxylic acid Formula: C15H20N2O6S MolecularWeight: 356.3941

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)CC(C(C(=O)C2(CC2N)C(=O)O)O)N

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)CC(C(C(=O)C2(CC2N)C(=O)O)O)N

InChI

InChI=1S/C15H20N2O6S/c1-24(22,23)9-4-2-8(3-5-9)6-10(16)12(18)13(19)15(14(20)21)7-11(15)17/h2-5,10-12,18H,6-7,16-17H2,1H3,(H,20,21)