2-[(4-ethylphenyl)sulfonylamino]-3-methyl-pentanoic acid

Systemtic Name: 2-[(4-ethylphenyl)sulfonylamino]-3-methyl-pentanoic acid Openeye Name: 2-[(4-ethylphenyl)sulfonylamino]-3-methyl-pentanoic acid CAS Name: 2-[(4-ethylphenyl)sulfonylamino]-3-methylpentanoic acid IUPAC Name: 2-[(4-ethylphenyl)sulfonylamino]-3-methylpentanoic acid Traditional Name: 2-[(4-ethylphenyl)sulfonylamino]-3-methyl-valeric acid Formula: C14H21NO4S MolecularWeight: 299.38584

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)NC(C(C)CC)C(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)NC(C(C)CC)C(=O)O

InChI

InChI=1S/C14H21NO4S/c1-4-10(3)13(14(16)17)15-20(18,19)12-8-6-11(5-2)7-9-12/h6-10,13,15H,4-5H2,1-3H3,(H,16,17)