5-[(2-methylsulfanylnaphthalen-1-yl)amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[(2-methylsulfanylnaphthalen-1-yl)amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[(2-methylsulfanyl-1-naphthyl)amino]-5-oxo-pentanoic acid CAS Name: 5-[[2-(methylthio)-1-naphthalenyl]amino]-5-oxopentanoic acid IUPAC Name: 5-[(2-methylsulfanylnaphthalen-1-yl)amino]-5-oxopentanoic acid Traditional Name: 5-keto-5-[[2-(methylthio)-1-naphthyl]amino]valeric acid Formula: C16H17NO3S MolecularWeight: 303.37608

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C2=CC=CC=C2C=C1)NC(=O)CCCC(=O)O

Isomeric SMILES

CSC1=C(C2=CC=CC=C2C=C1)NC(=O)CCCC(=O)O

InChI

InChI=1S/C16H17NO3S/c1-21-13-10-9-11-5-2-3-6-12(11)16(13)17-14(18)7-4-8-15(19)20/h2-3,5-6,9-10H,4,7-8H2,1H3,(H,17,18)(H,19,20)