methyl 3-[(2,6-dimethylquinolin-4-yl)amino]benzoate; molecular hydrogen; hydrochloride

Systemtic Name: methyl 3-[(2,6-dimethylquinolin-4-yl)amino]benzoate; molecular hydrogen; hydrochloride Openeye Name: methyl 3-[(2,6-dimethyl-4-quinolyl)amino]benzoate; molecular hydrogen; hydrochloride CAS Name: 3-[(2,6-dimethyl-4-quinolinyl)amino]benzoic acid methyl ester; molecular hydrogen; hydrochloride IUPAC Name: methyl 3-[(2,6-dimethylquinolin-4-yl)amino]benzoate; molecular hydrogen; hydrochloride Traditional Name: 3-[(2,6-dimethyl-4-quinolyl)amino]benzoic acid methyl ester; molecular hydrogen; hydrochloride Formula: C19H21ClN2O2 MolecularWeight: 344.83524

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Descriptors Computed from Structure

Canonical SMILES:

[HH].CC1=CC2=C(C=C1)N=C(C=C2NC3=CC=CC(=C3)C(=O)OC)C.Cl

Isomeric SMILES

[HH].CC1=CC2=C(C=C1)N=C(C=C2NC3=CC=CC(=C3)C(=O)OC)C.Cl

InChI

InChI=1S/C19H18N2O2.ClH.H2/c1-12-7-8-17-16(9-12)18(10-13(2)20-17)21-15-6-4-5-14(11-15)19(22)23-3;;/h4-11H,1-3H3,(H,20,21);2*1H