2-azanyl-5-[(4-fluorosulfonylphenyl)methylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 2-azanyl-5-[(4-fluorosulfonylphenyl)methylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 2-amino-5-[(4-fluorosulfonylphenyl)methylamino]-5-oxo-pentanoic acid CAS Name: 2-amino-5-[(4-fluorosulfonylphenyl)methylamino]-5-oxopentanoic acid IUPAC Name: 2-amino-5-[(4-fluorosulfonylphenyl)methylamino]-5-oxopentanoic acid Traditional Name: 2-amino-5-[(4-fluorosulfonylbenzyl)amino]-5-keto-valeric acid Formula: C12H15FN2O5S MolecularWeight: 318.321303

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)CCC(C(=O)O)N)S(=O)(=O)F

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)CCC(C(=O)O)N)S(=O)(=O)F

InChI

InChI=1S/C12H15FN2O5S/c13-21(19,20)9-3-1-8(2-4-9)7-15-11(16)6-5-10(14)12(17)18/h1-4,10H,5-7,14H2,(H,15,16)(H,17,18)