[1-[(8-methoxy-2-oxidanylidene-1H-quinolin-6-yl)carbonyl]piperidin-4-yl]-methyl-phenethyl-azanium chloride

Systemtic Name: [1-[(8-methoxy-2-oxidanylidene-1H-quinolin-6-yl)carbonyl]piperidin-4-yl]-methyl-phenethyl-azanium chloride Openeye Name: [1-(8-methoxy-2-oxo-1H-quinoline-6-carbonyl)-4-piperidyl]-methyl-phenethyl-ammonium chloride CAS Name: [1-[(8-methoxy-2-oxo-1H-quinolin-6-yl)-oxomethyl]-4-piperidinyl]-methyl-phenethylammonium chloride IUPAC Name: [1-(8-methoxy-2-oxo-1H-quinoline-6-carbonyl)piperidin-4-yl]-methyl-phenethylazanium chloride Traditional Name: [1-(2-keto-8-methoxy-1H-quinoline-6-carbonyl)-4-piperidyl]-methyl-phenethyl-ammonium chloride Formula: C25H30ClN3O3 MolecularWeight: 455.977

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC=CC=C1)C2CCN(CC2)C(=O)C3=CC(=C4C(=C3)C=CC(=O)N4)OC.[Cl-]

Isomeric SMILES

C[NH+](CCC1=CC=CC=C1)C2CCN(CC2)C(=O)C3=CC(=C4C(=C3)C=CC(=O)N4)OC.[Cl-]

InChI

InChI=1S/C25H29N3O3.ClH/c1-27(13-10-18-6-4-3-5-7-18)21-11-14-28(15-12-21)25(30)20-16-19-8-9-23(29)26-24(19)22(17-20)31-2;/h3-9,16-17,21H,10-15H2,1-2H3,(H,26,29);1H