[(4S)-2,2-dimethyloxan-4-yl]-[[2-(4-methoxyphenyl)-7-methyl-quinolin-3-yl]methyl]azanium

Systemtic Name: [(4S)-2,2-dimethyloxan-4-yl]-[[2-(4-methoxyphenyl)-7-methyl-quinolin-3-yl]methyl]azanium Openeye Name: [(4S)-2,2-dimethyltetrahydropyran-4-yl]-[[2-(4-methoxyphenyl)-7-methyl-3-quinolyl]methyl]ammonium CAS Name: [(4S)-2,2-dimethyl-4-oxanyl]-[[2-(4-methoxyphenyl)-7-methyl-3-quinolinyl]methyl]ammonium IUPAC Name: [(4S)-2,2-dimethyloxan-4-yl]-[[2-(4-methoxyphenyl)-7-methylquinolin-3-yl]methyl]azanium Traditional Name: [(4S)-2,2-dimethyltetrahydropyran-4-yl]-[[2-(4-methoxyphenyl)-7-methyl-3-quinolyl]methyl]ammonium Formula: C25H31N2O2+ MolecularWeight: 391.52584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(C=C2C=C1)C[NH2+]C3CCOC(C3)(C)C)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC2=NC(=C(C=C2C=C1)C[NH2+][C@H]3CCOC(C3)(C)C)C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H30N2O2/c1-17-5-6-19-14-20(16-26-21-11-12-29-25(2,3)15-21)24(27-23(19)13-17)18-7-9-22(28-4)10-8-18/h5-10,13-14,21,26H,11-12,15-16H2,1-4H3/p+1/t21-/m0/s1