(6-methoxycarbonyl-2-methyl-4-oxidanylidene-1H-quinolin-3-yl)methyl-bis(2-methylpropyl)azanium

Systemtic Name: (6-methoxycarbonyl-2-methyl-4-oxidanylidene-1H-quinolin-3-yl)methyl-bis(2-methylpropyl)azanium Openeye Name: diisobutyl-[(6-methoxycarbonyl-2-methyl-4-oxo-1H-quinolin-3-yl)methyl]ammonium CAS Name: (6-methoxycarbonyl-2-methyl-4-oxo-1H-quinolin-3-yl)methyl-bis(2-methylpropyl)ammonium IUPAC Name: (6-methoxycarbonyl-2-methyl-4-oxo-1H-quinolin-3-yl)methyl-bis(2-methylpropyl)azanium Traditional Name: (6-carbomethoxy-4-keto-2-methyl-1H-quinolin-3-yl)methyl-diisobutyl-ammonium Formula: C21H31N2O3+ MolecularWeight: 359.48244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(N1)C=CC(=C2)C(=O)OC)C[NH+](CC(C)C)CC(C)C

Isomeric SMILES

CC1=C(C(=O)C2=C(N1)C=CC(=C2)C(=O)OC)C[NH+](CC(C)C)CC(C)C

InChI

InChI=1S/C21H30N2O3/c1-13(2)10-23(11-14(3)4)12-18-15(5)22-19-8-7-16(21(25)26-6)9-17(19)20(18)24/h7-9,13-14H,10-12H2,1-6H3,(H,22,24)/p+1