(2S)-2-(2,3-dihydro-1H-cyclopenta[b]quinolin-9-ylcarbonylamino)-3-sulfanyl-propanoic acid

Systemtic Name: (2S)-2-(2,3-dihydro-1H-cyclopenta[b]quinolin-9-ylcarbonylamino)-3-sulfanyl-propanoic acid Openeye Name: (2S)-2-(2,3-dihydro-1H-cyclopenta[b]quinoline-9-carbonylamino)-3-sulfanyl-propanoic acid CAS Name: (2S)-2-[[2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl(oxo)methyl]amino]-3-mercaptopropanoic acid IUPAC Name: (2S)-2-(2,3-dihydro-1H-cyclopenta[b]quinoline-9-carbonylamino)-3-sulfanylpropanoic acid Traditional Name: (2S)-2-(2,3-dihydro-1H-cyclopenta[b]quinoline-9-carbonylamino)-3-mercapto-propionic acid Formula: C16H16N2O3S MolecularWeight: 316.37484

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C3=CC=CC=C3N=C2C1)C(=O)NC(CS)C(=O)O

Isomeric SMILES

C1CC2=C(C3=CC=CC=C3N=C2C1)C(=O)N[C@H](CS)C(=O)O

InChI

InChI=1S/C16H16N2O3S/c19-15(18-13(8-22)16(20)21)14-9-4-1-2-6-11(9)17-12-7-3-5-10(12)14/h1-2,4,6,13,22H,3,5,7-8H2,(H,18,19)(H,20,21)/t13-/m1/s1