2-azanyl-3-(7-methylnaphthalen-1-yl)sulfanyl-propanoic acid

Systemtic Name: 2-azanyl-3-(7-methylnaphthalen-1-yl)sulfanyl-propanoic acid Openeye Name: 2-amino-3-[(7-methyl-1-naphthyl)sulfanyl]propanoic acid CAS Name: 2-amino-3-[(7-methyl-1-naphthalenyl)thio]propanoic acid IUPAC Name: 2-amino-3-(7-methylnaphthalen-1-yl)sulfanylpropanoic acid Traditional Name: 2-amino-3-[(7-methyl-1-naphthyl)thio]propionic acid Formula: C14H15NO2S MolecularWeight: 261.3394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=CC=C2SCC(C(=O)O)N)C=C1

Isomeric SMILES

CC1=CC2=C(C=CC=C2SCC(C(=O)O)N)C=C1

InChI

InChI=1S/C14H15NO2S/c1-9-5-6-10-3-2-4-13(11(10)7-9)18-8-12(15)14(16)17/h2-7,12H,8,15H2,1H3,(H,16,17)