2-methylpropyl 4-(4-azanyl-6,7-dimethoxy-quinolin-2-yl)piperazine-1-carboxylate hydrochloride

Systemtic Name: 2-methylpropyl 4-(4-azanyl-6,7-dimethoxy-quinolin-2-yl)piperazine-1-carboxylate hydrochloride Openeye Name: isobutyl 4-(4-amino-6,7-dimethoxy-2-quinolyl)piperazine-1-carboxylate hydrochloride CAS Name: 4-(4-amino-6,7-dimethoxy-2-quinolinyl)-1-piperazinecarboxylic acid 2-methylpropyl ester hydrochloride IUPAC Name: 2-methylpropyl 4-(4-amino-6,7-dimethoxyquinolin-2-yl)piperazine-1-carboxylate hydrochloride Traditional Name: 4-(4-amino-6,7-dimethoxy-2-quinolyl)piperazine-1-carboxylic acid isobutyl ester hydrochloride Formula: C20H29ClN4O4 MolecularWeight: 424.92166

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)N1CCN(CC1)C2=NC3=CC(=C(C=C3C(=C2)N)OC)OC.Cl

Isomeric SMILES

CC(C)COC(=O)N1CCN(CC1)C2=NC3=CC(=C(C=C3C(=C2)N)OC)OC.Cl

InChI

InChI=1S/C20H28N4O4.ClH/c1-13(2)12-28-20(25)24-7-5-23(6-8-24)19-10-15(21)14-9-17(26-3)18(27-4)11-16(14)22-19;/h9-11,13H,5-8,12H2,1-4H3,(H2,21,22);1H