(2-ethoxycarbonyl-4-oxidanylidene-1H-quinolin-3-yl)methyl-ethyl-(phenylmethyl)azanium

Systemtic Name: (2-ethoxycarbonyl-4-oxidanylidene-1H-quinolin-3-yl)methyl-ethyl-(phenylmethyl)azanium Openeye Name: benzyl-[(2-ethoxycarbonyl-4-oxo-1H-quinolin-3-yl)methyl]-ethyl-ammonium CAS Name: (2-ethoxycarbonyl-4-oxo-1H-quinolin-3-yl)methyl-ethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[(2-ethoxycarbonyl-4-oxo-1H-quinolin-3-yl)methyl]-ethylazanium Traditional Name: benzyl-[(2-carbethoxy-4-keto-1H-quinolin-3-yl)methyl]-ethyl-ammonium Formula: C22H25N2O3+ MolecularWeight: 365.4455

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CC=C1)CC2=C(NC3=CC=CC=C3C2=O)C(=O)OCC

Isomeric SMILES

CC[NH+](CC1=CC=CC=C1)CC2=C(NC3=CC=CC=C3C2=O)C(=O)OCC

InChI

InChI=1S/C22H24N2O3/c1-3-24(14-16-10-6-5-7-11-16)15-18-20(22(26)27-4-2)23-19-13-9-8-12-17(19)21(18)25/h5-13H,3-4,14-15H2,1-2H3,(H,23,25)/p+1