(7-chloranyl-2-morpholin-4-yl-quinolin-1-ium-3-yl)methyl-[(2S)-2-oxidanylpropyl]azanium

Systemtic Name: (7-chloranyl-2-morpholin-4-yl-quinolin-1-ium-3-yl)methyl-[(2S)-2-oxidanylpropyl]azanium Openeye Name: (7-chloro-2-morpholino-quinolin-1-ium-3-yl)methyl-[(2S)-2-hydroxypropyl]ammonium CAS Name: [7-chloro-2-(4-morpholinyl)-3-quinolin-1-iumyl]methyl-[(2S)-2-hydroxypropyl]ammonium IUPAC Name: (7-chloro-2-morpholin-4-ylquinolin-1-ium-3-yl)methyl-[(2S)-2-hydroxypropyl]azanium Traditional Name: (7-chloro-2-morpholino-quinolin-1-ium-3-yl)methyl-[(2S)-2-hydroxypropyl]ammonium Formula: C17H24ClN3O2+2 MolecularWeight: 337.84436

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH2+]CC1=C([NH+]=C2C=C(C=CC2=C1)Cl)N3CCOCC3)O

Isomeric SMILES

C[C@@H](C[NH2+]CC1=C([NH+]=C2C=C(C=CC2=C1)Cl)N3CCOCC3)O

InChI

InChI=1S/C17H22ClN3O2/c1-12(22)10-19-11-14-8-13-2-3-15(18)9-16(13)20-17(14)21-4-6-23-7-5-21/h2-3,8-9,12,19,22H,4-7,10-11H2,1H3/p+2/t12-/m0/s1