6-methoxy-4-[(phenylmethyl)amino]quinoline-3-carboxylic acid hydrochloride

Systemtic Name: 6-methoxy-4-[(phenylmethyl)amino]quinoline-3-carboxylic acid hydrochloride Openeye Name: 4-(benzylamino)-6-methoxy-quinoline-3-carboxylic acid hydrochloride CAS Name: 6-methoxy-4-[(phenylmethyl)amino]-3-quinolinecarboxylic acid hydrochloride IUPAC Name: 4-(benzylamino)-6-methoxyquinoline-3-carboxylic acid hydrochloride Traditional Name: 4-(benzylamino)-6-methoxy-quinoline-3-carboxylic acid hydrochloride Formula: C18H17ClN2O3 MolecularWeight: 344.79218

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C(=CN=C2C=C1)C(=O)O)NCC3=CC=CC=C3.Cl

Isomeric SMILES

COC1=CC2=C(C(=CN=C2C=C1)C(=O)O)NCC3=CC=CC=C3.Cl

InChI

InChI=1S/C18H16N2O3.ClH/c1-23-13-7-8-16-14(9-13)17(15(11-19-16)18(21)22)20-10-12-5-3-2-4-6-12;/h2-9,11H,10H2,1H3,(H,19,20)(H,21,22);1H