(8-chloranylquinolin-2-yl)methyl-[(3-methylthiophen-2-yl)methyl]-(3-oxidanylpropyl)azanium

Systemtic Name: (8-chloranylquinolin-2-yl)methyl-[(3-methylthiophen-2-yl)methyl]-(3-oxidanylpropyl)azanium Openeye Name: (8-chloro-2-quinolyl)methyl-(3-hydroxypropyl)-[(3-methyl-2-thienyl)methyl]ammonium CAS Name: (8-chloro-2-quinolinyl)methyl-(3-hydroxypropyl)-[(3-methyl-2-thiophenyl)methyl]ammonium IUPAC Name: (8-chloroquinolin-2-yl)methyl-(3-hydroxypropyl)-[(3-methylthiophen-2-yl)methyl]azanium Traditional Name: (8-chloro-2-quinolyl)methyl-(3-hydroxypropyl)-[(3-methyl-2-thienyl)methyl]ammonium Formula: C19H22ClN2OS+ MolecularWeight: 361.90878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C[NH+](CCCO)CC2=NC3=C(C=CC=C3Cl)C=C2

Isomeric SMILES

CC1=C(SC=C1)C[NH+](CCCO)CC2=NC3=C(C=CC=C3Cl)C=C2

InChI

InChI=1S/C19H21ClN2OS/c1-14-8-11-24-18(14)13-22(9-3-10-23)12-16-7-6-15-4-2-5-17(20)19(15)21-16/h2,4-8,11,23H,3,9-10,12-13H2,1H3/p+1