[7-chloranyl-2-(2-phenoxyethoxy)quinolin-3-yl]methyl-[(4R)-2,2-dimethyloxan-4-yl]azanium

Systemtic Name: [7-chloranyl-2-(2-phenoxyethoxy)quinolin-3-yl]methyl-[(4R)-2,2-dimethyloxan-4-yl]azanium Openeye Name: [7-chloro-2-(2-phenoxyethoxy)-3-quinolyl]methyl-[(4R)-2,2-dimethyltetrahydropyran-4-yl]ammonium CAS Name: [7-chloro-2-(2-phenoxyethoxy)-3-quinolinyl]methyl-[(4R)-2,2-dimethyl-4-oxanyl]ammonium IUPAC Name: [7-chloro-2-(2-phenoxyethoxy)quinolin-3-yl]methyl-[(4R)-2,2-dimethyloxan-4-yl]azanium Traditional Name: [7-chloro-2-(2-phenoxyethoxy)-3-quinolyl]methyl-[(4R)-2,2-dimethyltetrahydropyran-4-yl]ammonium Formula: C25H30ClN2O3+ MolecularWeight: 441.9703

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CCO1)[NH2+]CC2=C(N=C3C=C(C=CC3=C2)Cl)OCCOC4=CC=CC=C4)C

Isomeric SMILES

CC1(C[C@@H](CCO1)[NH2+]CC2=C(N=C3C=C(C=CC3=C2)Cl)OCCOC4=CC=CC=C4)C

InChI

InChI=1S/C25H29ClN2O3/c1-25(2)16-21(10-11-31-25)27-17-19-14-18-8-9-20(26)15-23(18)28-24(19)30-13-12-29-22-6-4-3-5-7-22/h3-9,14-15,21,27H,10-13,16-17H2,1-2H3/p+1/t21-/m1/s1