(6-chloranylquinolin-4-yl)methyl-[(3-methylthiophen-2-yl)methyl]-(3-oxidanylpropyl)azanium

Systemtic Name: (6-chloranylquinolin-4-yl)methyl-[(3-methylthiophen-2-yl)methyl]-(3-oxidanylpropyl)azanium Openeye Name: (6-chloro-4-quinolyl)methyl-(3-hydroxypropyl)-[(3-methyl-2-thienyl)methyl]ammonium CAS Name: (6-chloro-4-quinolinyl)methyl-(3-hydroxypropyl)-[(3-methyl-2-thiophenyl)methyl]ammonium IUPAC Name: (6-chloroquinolin-4-yl)methyl-(3-hydroxypropyl)-[(3-methylthiophen-2-yl)methyl]azanium Traditional Name: (6-chloro-4-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=C3C=C(C=CC3=NC=C2)Cl

Isomeric SMILES

CC1=C(SC=C1)C[NH+](CCCO)CC2=C3C=C(C=CC3=NC=C2)Cl

InChI

InChI=1S/C19H21ClN2OS/c1-14-6-10-24-19(14)13-22(8-2-9-23)12-15-5-7-21-18-4-3-16(20)11-17(15)18/h3-7,10-11,23H,2,8-9,12-13H2,1H3/p+1