(8-methyl-2-thiophen-2-yl-quinolin-3-yl)methyl-[(2S)-2-oxidanylpropyl]azanium

Systemtic Name: (8-methyl-2-thiophen-2-yl-quinolin-3-yl)methyl-[(2S)-2-oxidanylpropyl]azanium Openeye Name: [(2S)-2-hydroxypropyl]-[[8-methyl-2-(2-thienyl)-3-quinolyl]methyl]ammonium CAS Name: [(2S)-2-hydroxypropyl]-[(8-methyl-2-thiophen-2-yl-3-quinolinyl)methyl]ammonium IUPAC Name: [(2S)-2-hydroxypropyl]-[(8-methyl-2-thiophen-2-ylquinolin-3-yl)methyl]azanium Traditional Name: [(2S)-2-hydroxypropyl]-[[8-methyl-2-(2-thienyl)-3-quinolyl]methyl]ammonium Formula: C18H21N2OS+ MolecularWeight: 313.43714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=CC(=C(N=C12)C3=CC=CS3)C[NH2+]CC(C)O

Isomeric SMILES

CC1=CC=CC2=CC(=C(N=C12)C3=CC=CS3)C[NH2+]C[C@H](C)O

InChI

InChI=1S/C18H20N2OS/c1-12-5-3-6-14-9-15(11-19-10-13(2)21)18(20-17(12)14)16-7-4-8-22-16/h3-9,13,19,21H,10-11H2,1-2H3/p+1/t13-/m0/s1