dibutyl-[(6-ethoxycarbonyl-2-methyl-4-oxidanylidene-1H-quinolin-3-yl)methyl]azanium

Systemtic Name: dibutyl-[(6-ethoxycarbonyl-2-methyl-4-oxidanylidene-1H-quinolin-3-yl)methyl]azanium Openeye Name: dibutyl-[(6-ethoxycarbonyl-2-methyl-4-oxo-1H-quinolin-3-yl)methyl]ammonium CAS Name: dibutyl-[(6-ethoxycarbonyl-2-methyl-4-oxo-1H-quinolin-3-yl)methyl]ammonium IUPAC Name: dibutyl-[(6-ethoxycarbonyl-2-methyl-4-oxo-1H-quinolin-3-yl)methyl]azanium Traditional Name: dibutyl-[(6-carbethoxy-4-keto-2-methyl-1H-quinolin-3-yl)methyl]ammonium Formula: C22H33N2O3+ MolecularWeight: 373.50902

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CCCC)CC1=C(NC2=C(C1=O)C=C(C=C2)C(=O)OCC)C

Isomeric SMILES

CCCC[NH+](CCCC)CC1=C(NC2=C(C1=O)C=C(C=C2)C(=O)OCC)C

InChI

InChI=1S/C22H32N2O3/c1-5-8-12-24(13-9-6-2)15-19-16(4)23-20-11-10-17(22(26)27-7-3)14-18(20)21(19)25/h10-11,14H,5-9,12-13,15H2,1-4H3,(H,23,25)/p+1