2-azanyl-4-chloranyl-5-(4-nitrophenyl)sulfanyl-pentanoic acid

Systemtic Name: 2-azanyl-4-chloranyl-5-(4-nitrophenyl)sulfanyl-pentanoic acid Openeye Name: 2-amino-4-chloro-5-(4-nitrophenyl)sulfanyl-pentanoic acid CAS Name: 2-amino-4-chloro-5-[(4-nitrophenyl)thio]pentanoic acid IUPAC Name: 2-amino-4-chloro-5-(4-nitrophenyl)sulfanylpentanoic acid Traditional Name: 2-amino-4-chloro-5-[(4-nitrophenyl)thio]valeric acid Formula: C11H13ClN2O4S MolecularWeight: 304.74992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])SCC(CC(C(=O)O)N)Cl

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])SCC(CC(C(=O)O)N)Cl

InChI

InChI=1S/C11H13ClN2O4S/c12-7(5-10(13)11(15)16)6-19-9-3-1-8(2-4-9)14(17)18/h1-4,7,10H,5-6,13H2,(H,15,16)