[(4S)-2,2-dimethyloxan-4-yl]-[(7-methyl-2-oxidanylidene-1-phenethyl-quinolin-3-yl)methyl]azanium

Systemtic Name: [(4S)-2,2-dimethyloxan-4-yl]-[(7-methyl-2-oxidanylidene-1-phenethyl-quinolin-3-yl)methyl]azanium Openeye Name: [(4S)-2,2-dimethyltetrahydropyran-4-yl]-[(7-methyl-2-oxo-1-phenethyl-3-quinolyl)methyl]ammonium CAS Name: [(4S)-2,2-dimethyl-4-oxanyl]-[(7-methyl-2-oxo-1-phenethyl-3-quinolinyl)methyl]ammonium IUPAC Name: [(4S)-2,2-dimethyloxan-4-yl]-[(7-methyl-2-oxo-1-phenethylquinolin-3-yl)methyl]azanium Traditional Name: [(4S)-2,2-dimethyltetrahydropyran-4-yl]-[(2-keto-7-methyl-1-phenethyl-3-quinolyl)methyl]ammonium Formula: C26H33N2O2+ MolecularWeight: 405.55242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=O)N2CCC3=CC=CC=C3)C[NH2+]C4CCOC(C4)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=O)N2CCC3=CC=CC=C3)C[NH2+][C@H]4CCOC(C4)(C)C

InChI

InChI=1S/C26H32N2O2/c1-19-9-10-21-16-22(18-27-23-12-14-30-26(2,3)17-23)25(29)28(24(21)15-19)13-11-20-7-5-4-6-8-20/h4-10,15-16,23,27H,11-14,17-18H2,1-3H3/p+1/t23-/m0/s1