ethyl 4-(phenethylamino)benzo[h]quinolin-1-ium-3-carboxylate

Systemtic Name: ethyl 4-(phenethylamino)benzo[h]quinolin-1-ium-3-carboxylate Openeye Name: ethyl 4-(phenethylamino)benzo[h]quinolin-1-ium-3-carboxylate CAS Name: 4-(phenethylamino)-3-benzo[h]quinolin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-(phenethylamino)benzo[h]quinolin-1-ium-3-carboxylate Traditional Name: 4-(phenethylamino)benzo[h]quinolin-1-ium-3-carboxylic acid ethyl ester Formula: C24H23N2O2+ MolecularWeight: 371.45162

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C[NH+]=C2C(=C1NCCC3=CC=CC=C3)C=CC4=CC=CC=C42

Isomeric SMILES

CCOC(=O)C1=C[NH+]=C2C(=C1NCCC3=CC=CC=C3)C=CC4=CC=CC=C42

InChI

InChI=1S/C24H22N2O2/c1-2-28-24(27)21-16-26-22-19-11-7-6-10-18(19)12-13-20(22)23(21)25-15-14-17-8-4-3-5-9-17/h3-13,16H,2,14-15H2,1H3,(H,25,26)/p+1