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

Systemtic Name: (2-ethoxycarbonyl-4-oxidanylidene-1H-quinolin-3-yl)methyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[(2-ethoxycarbonyl-4-oxo-1H-quinolin-3-yl)methyl]-methyl-ammonium CAS Name: (2-ethoxycarbonyl-4-oxo-1H-quinolin-3-yl)methyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[(2-ethoxycarbonyl-4-oxo-1H-quinolin-3-yl)methyl]-methylazanium Traditional Name: benzyl-[(2-carbethoxy-4-keto-1H-quinolin-3-yl)methyl]-methyl-ammonium Formula: C21H23N2O3+ MolecularWeight: 351.41892

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)C2=CC=CC=C2N1)C[NH+](C)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C(=O)C2=CC=CC=C2N1)C[NH+](C)CC3=CC=CC=C3

InChI

InChI=1S/C21H22N2O3/c1-3-26-21(25)19-17(14-23(2)13-15-9-5-4-6-10-15)20(24)16-11-7-8-12-18(16)22-19/h4-12H,3,13-14H2,1-2H3,(H,22,24)/p+1