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

Systemtic Name: [6-(dimethylamino)-2-ethoxycarbonyl-4-oxidanylidene-1H-quinolin-3-yl]methyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[[6-(dimethylamino)-2-ethoxycarbonyl-4-oxo-1H-quinolin-3-yl]methyl]-methyl-ammonium CAS Name: [6-(dimethylamino)-2-ethoxycarbonyl-4-oxo-1H-quinolin-3-yl]methyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[[6-(dimethylamino)-2-ethoxycarbonyl-4-oxo-1H-quinolin-3-yl]methyl]-methylazanium Traditional Name: benzyl-[[2-carbethoxy-6-(dimethylamino)-4-keto-1H-quinolin-3-yl]methyl]-methyl-ammonium Formula: C23H28N3O3+ MolecularWeight: 394.48672

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)C2=C(N1)C=CC(=C2)N(C)C)C[NH+](C)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C(=O)C2=C(N1)C=CC(=C2)N(C)C)C[NH+](C)CC3=CC=CC=C3

InChI

InChI=1S/C23H27N3O3/c1-5-29-23(28)21-19(15-26(4)14-16-9-7-6-8-10-16)22(27)18-13-17(25(2)3)11-12-20(18)24-21/h6-13H,5,14-15H2,1-4H3,(H,24,27)/p+1