[3-[1-(2-cyclopropylquinolin-4-yl)carbonylpiperidin-4-yl]oxyphenyl]methyl-methyl-(thiophen-2-ylmethyl)azanium

Systemtic Name: [3-[1-(2-cyclopropylquinolin-4-yl)carbonylpiperidin-4-yl]oxyphenyl]methyl-methyl-(thiophen-2-ylmethyl)azanium Openeye Name: [3-[[1-(2-cyclopropylquinoline-4-carbonyl)-4-piperidyl]oxy]phenyl]methyl-methyl-(2-thienylmethyl)ammonium CAS Name: [3-[[1-[(2-cyclopropyl-4-quinolinyl)-oxomethyl]-4-piperidinyl]oxy]phenyl]methyl-methyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: [3-[1-(2-cyclopropylquinoline-4-carbonyl)piperidin-4-yl]oxyphenyl]methyl-methyl-(thiophen-2-ylmethyl)azanium Traditional Name: [3-[[1-(2-cyclopropylquinoline-4-carbonyl)-4-piperidyl]oxy]benzyl]-methyl-(2-thenyl)ammonium Formula: C31H34N3O2S+ MolecularWeight: 512.68556

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC(=CC=C1)OC2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5CC5)CC6=CC=CS6

Isomeric SMILES

C[NH+](CC1=CC(=CC=C1)OC2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5CC5)CC6=CC=CS6

InChI

InChI=1S/C31H33N3O2S/c1-33(21-26-8-5-17-37-26)20-22-6-4-7-25(18-22)36-24-13-15-34(16-14-24)31(35)28-19-30(23-11-12-23)32-29-10-3-2-9-27(28)29/h2-10,17-19,23-24H,11-16,20-21H2,1H3/p+1