methyl 3-[[2-(sulfanylmethyl)-3,4-dihydro-1H-naphthalen-2-yl]carbonylamino]propanoate

Systemtic Name: methyl 3-[[2-(sulfanylmethyl)-3,4-dihydro-1H-naphthalen-2-yl]carbonylamino]propanoate Openeye Name: methyl 3-[[2-(sulfanylmethyl)tetralin-2-carbonyl]amino]propanoate CAS Name: 3-[[[2-(mercaptomethyl)-3,4-dihydro-1H-naphthalen-2-yl]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-[[2-(sulfanylmethyl)-3,4-dihydro-1H-naphthalene-2-carbonyl]amino]propanoate Traditional Name: 3-[[2-(mercaptomethyl)tetralin-2-carbonyl]amino]propionic acid methyl ester Formula: C16H21NO3S MolecularWeight: 307.40784

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCNC(=O)C1(CCC2=CC=CC=C2C1)CS

Isomeric SMILES

COC(=O)CCNC(=O)C1(CCC2=CC=CC=C2C1)CS

InChI

InChI=1S/C16H21NO3S/c1-20-14(18)7-9-17-15(19)16(11-21)8-6-12-4-2-3-5-13(12)10-16/h2-5,21H,6-11H2,1H3,(H,17,19)