(2R)-2-[[3-chloranyl-1,4-bis(oxidanylidene)naphthalen-2-yl]amino]-4-methylsulfanyl-butanoate

Systemtic Name: (2R)-2-[[3-chloranyl-1,4-bis(oxidanylidene)naphthalen-2-yl]amino]-4-methylsulfanyl-butanoate Openeye Name: (2R)-2-[(3-chloro-1,4-dioxo-2-naphthyl)amino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[(3-chloro-1,4-dioxo-2-naphthalenyl)amino]-4-(methylthio)butanoate IUPAC Name: (2R)-2-[(3-chloro-1,4-dioxonaphthalen-2-yl)amino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[(3-chloro-1,4-diketo-2-naphthyl)amino]-4-(methylthio)butyrate Formula: C15H13ClNO4S- MolecularWeight: 338.78602

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)[O-])NC1=C(C(=O)C2=CC=CC=C2C1=O)Cl

Isomeric SMILES

CSCC[C@H](C(=O)[O-])NC1=C(C(=O)C2=CC=CC=C2C1=O)Cl

InChI

InChI=1S/C15H14ClNO4S/c1-22-7-6-10(15(20)21)17-12-11(16)13(18)8-4-2-3-5-9(8)14(12)19/h2-5,10,17H,6-7H2,1H3,(H,20,21)/p-1/t10-/m1/s1