1-adamantyl-[[7-chloranyl-1-(2-methoxy-2-oxidanylidene-ethyl)-2-oxidanylidene-quinolin-3-yl]methyl]azanium

Systemtic Name: 1-adamantyl-[[7-chloranyl-1-(2-methoxy-2-oxidanylidene-ethyl)-2-oxidanylidene-quinolin-3-yl]methyl]azanium Openeye Name: 1-adamantyl-[[7-chloro-1-(2-methoxy-2-oxo-ethyl)-2-oxo-3-quinolyl]methyl]ammonium CAS Name: 1-adamantyl-[[7-chloro-1-(2-methoxy-2-oxoethyl)-2-oxo-3-quinolinyl]methyl]ammonium IUPAC Name: 1-adamantyl-[[7-chloro-1-(2-methoxy-2-oxoethyl)-2-oxoquinolin-3-yl]methyl]azanium Traditional Name: 1-adamantyl-[[7-chloro-2-keto-1-(2-keto-2-methoxy-ethyl)-3-quinolyl]methyl]ammonium Formula: C23H28ClN2O3+ MolecularWeight: 415.93302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C2=C(C=CC(=C2)Cl)C=C(C1=O)C[NH2+]C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC(=O)CN1C2=C(C=CC(=C2)Cl)C=C(C1=O)C[NH2+]C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H27ClN2O3/c1-29-21(27)13-26-20-8-19(24)3-2-17(20)7-18(22(26)28)12-25-23-9-14-4-15(10-23)6-16(5-14)11-23/h2-3,7-8,14-16,25H,4-6,9-13H2,1H3/p+1