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

Systemtic Name: [1-(2-chloranylprop-2-enyl)-7-methyl-2-oxidanylidene-quinolin-3-yl]methyl-[(4S)-2,2-dimethyloxan-4-yl]azanium Openeye Name: [1-(2-chloroallyl)-7-methyl-2-oxo-3-quinolyl]methyl-[(4S)-2,2-dimethyltetrahydropyran-4-yl]ammonium CAS Name: [1-(2-chloroprop-2-enyl)-7-methyl-2-oxo-3-quinolinyl]methyl-[(4S)-2,2-dimethyl-4-oxanyl]ammonium IUPAC Name: [1-(2-chloroprop-2-enyl)-7-methyl-2-oxoquinolin-3-yl]methyl-[(4S)-2,2-dimethyloxan-4-yl]azanium Traditional Name: [1-(2-chloroallyl)-2-keto-7-methyl-3-quinolyl]methyl-[(4S)-2,2-dimethyltetrahydropyran-4-yl]ammonium Formula: C21H28ClN2O2+ MolecularWeight: 375.91222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=O)N2CC(=C)Cl)C[NH2+]C3CCOC(C3)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=O)N2CC(=C)Cl)C[NH2+][C@H]3CCOC(C3)(C)C

InChI

InChI=1S/C21H27ClN2O2/c1-14-5-6-16-10-17(12-23-18-7-8-26-21(3,4)11-18)20(25)24(13-15(2)22)19(16)9-14/h5-6,9-10,18,23H,2,7-8,11-13H2,1,3-4H3/p+1/t18-/m0/s1