[2-[(2S)-octan-2-yl]oxyquinolin-3-yl]methylazanium

Systemtic Name: [2-[(2S)-octan-2-yl]oxyquinolin-3-yl]methylazanium Openeye Name: [2-[(1S)-1-methylheptoxy]-3-quinolyl]methylammonium CAS Name: [2-[(2S)-octan-2-yl]oxy-3-quinolinyl]methylammonium IUPAC Name: [2-[(2S)-octan-2-yl]oxyquinolin-3-yl]methylazanium Traditional Name: [2-[(1S)-1-methylheptoxy]-3-quinolyl]methylammonium Formula: C18H27N2O+ MolecularWeight: 287.41978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC1=NC2=CC=CC=C2C=C1C[NH3+]

Isomeric SMILES

CCCCCC[C@H](C)OC1=NC2=CC=CC=C2C=C1C[NH3+]

InChI

InChI=1S/C18H26N2O/c1-3-4-5-6-9-14(2)21-18-16(13-19)12-15-10-7-8-11-17(15)20-18/h7-8,10-12,14H,3-6,9,13,19H2,1-2H3/p+1/t14-/m0/s1