2-[[(2S)-1-azanyl-4-methyl-1-oxidanylidene-pentan-2-yl]-(4-chlorophenyl)sulfonyl-amino]ethanoic acid

Systemtic Name: 2-[[(2S)-1-azanyl-4-methyl-1-oxidanylidene-pentan-2-yl]-(4-chlorophenyl)sulfonyl-amino]ethanoic acid Openeye Name: 2-[[(1S)-1-carbamoyl-3-methyl-butyl]-(4-chlorophenyl)sulfonyl-amino]acetic acid CAS Name: 2-[[(2S)-1-amino-4-methyl-1-oxopentan-2-yl]-(4-chlorophenyl)sulfonylamino]acetic acid IUPAC Name: 2-[[(2S)-1-amino-4-methyl-1-oxopentan-2-yl]-(4-chlorophenyl)sulfonylamino]acetic acid Traditional Name: 2-[[(1S)-1-carbamoyl-3-methyl-butyl]-(4-chlorophenyl)sulfonyl-amino]acetic acid Formula: C14H19ClN2O5S MolecularWeight: 362.82906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N)N(CC(=O)O)S(=O)(=O)C1=CC=C(C=C1)Cl

Isomeric SMILES

CC(C)C[C@@H](C(=O)N)N(CC(=O)O)S(=O)(=O)C1=CC=C(C=C1)Cl

InChI

InChI=1S/C14H19ClN2O5S/c1-9(2)7-12(14(16)20)17(8-13(18)19)23(21,22)11-5-3-10(15)4-6-11/h3-6,9,12H,7-8H2,1-2H3,(H2,16,20)(H,18,19)/t12-/m0/s1