1-(2-azanyl-3-methyl-butanoyl)-2-[(4-chlorophenyl)sulfonylcarbamoyl]-1-(phenylcarbonyl)pyrrolidin-1-ium-2-carboxylic acid

Systemtic Name: 1-(2-azanyl-3-methyl-butanoyl)-2-[(4-chlorophenyl)sulfonylcarbamoyl]-1-(phenylcarbonyl)pyrrolidin-1-ium-2-carboxylic acid Openeye Name: 1-(2-amino-3-methyl-butanoyl)-1-benzoyl-2-[(4-chlorophenyl)sulfonylcarbamoyl]pyrrolidin-1-ium-2-carboxylic acid CAS Name: 1-(2-amino-3-methyl-1-oxobutyl)-1-benzoyl-2-[[(4-chlorophenyl)sulfonylamino]-oxomethyl]-2-pyrrolidin-1-iumcarboxylic acid IUPAC Name: 1-(2-amino-3-methylbutanoyl)-1-benzoyl-2-[(4-chlorophenyl)sulfonylcarbamoyl]pyrrolidin-1-ium-2-carboxylic acid Traditional Name: 1-(2-amino-3-methyl-butanoyl)-1-benzoyl-2-[(4-chlorophenyl)sulfonylcarbamoyl]pyrrolidin-1-ium-2-carboxylic acid Formula: C24H27ClN3O7S+ MolecularWeight: 537.00508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[N+]1(CCCC1(C(=O)NS(=O)(=O)C2=CC=C(C=C2)Cl)C(=O)O)C(=O)C3=CC=CC=C3)N

Isomeric SMILES

CC(C)C(C(=O)[N+]1(CCCC1(C(=O)NS(=O)(=O)C2=CC=C(C=C2)Cl)C(=O)O)C(=O)C3=CC=CC=C3)N

InChI

InChI=1S/C24H26ClN3O7S/c1-15(2)19(26)21(30)28(20(29)16-7-4-3-5-8-16)14-6-13-24(28,23(32)33)22(31)27-36(34,35)18-11-9-17(25)10-12-18/h3-5,7-12,15,19H,6,13-14,26H2,1-2H3,(H-,27,31,32,33)/p+1