ethyl 4-(cyclohexylamino)-6-methyl-quinolin-1-ium-3-carboxylate

Systemtic Name: ethyl 4-(cyclohexylamino)-6-methyl-quinolin-1-ium-3-carboxylate Openeye Name: ethyl 4-(cyclohexylamino)-6-methyl-quinolin-1-ium-3-carboxylate CAS Name: 4-(cyclohexylamino)-6-methyl-3-quinolin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-(cyclohexylamino)-6-methylquinolin-1-ium-3-carboxylate Traditional Name: 4-(cyclohexylamino)-6-methyl-quinolin-1-ium-3-carboxylic acid ethyl ester Formula: C19H25N2O2+ MolecularWeight: 313.414

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C[NH+]=C2C=CC(=CC2=C1NC3CCCCC3)C

Isomeric SMILES

CCOC(=O)C1=C[NH+]=C2C=CC(=CC2=C1NC3CCCCC3)C

InChI

InChI=1S/C19H24N2O2/c1-3-23-19(22)16-12-20-17-10-9-13(2)11-15(17)18(16)21-14-7-5-4-6-8-14/h9-12,14H,3-8H2,1-2H3,(H,20,21)/p+1