cyclopentyl-[[2-[(3S)-3-ethoxycarbonylpiperidin-1-yl]-6,7-dimethoxy-quinolin-3-yl]methyl]azanium

Systemtic Name: cyclopentyl-[[2-[(3S)-3-ethoxycarbonylpiperidin-1-yl]-6,7-dimethoxy-quinolin-3-yl]methyl]azanium Openeye Name: cyclopentyl-[[2-[(3S)-3-ethoxycarbonyl-1-piperidyl]-6,7-dimethoxy-3-quinolyl]methyl]ammonium CAS Name: cyclopentyl-[[2-[(3S)-3-ethoxycarbonyl-1-piperidinyl]-6,7-dimethoxy-3-quinolinyl]methyl]ammonium IUPAC Name: cyclopentyl-[[2-[(3S)-3-ethoxycarbonylpiperidin-1-yl]-6,7-dimethoxyquinolin-3-yl]methyl]azanium Traditional Name: [2-[(3S)-3-carbethoxypiperidino]-6,7-dimethoxy-3-quinolyl]methyl-cyclopentyl-ammonium Formula: C25H36N3O4+ MolecularWeight: 442.57104

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C2=C(C=C3C=C(C(=CC3=N2)OC)OC)C[NH2+]C4CCCC4

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)C2=C(C=C3C=C(C(=CC3=N2)OC)OC)C[NH2+]C4CCCC4

InChI

InChI=1S/C25H35N3O4/c1-4-32-25(29)17-8-7-11-28(16-17)24-19(15-26-20-9-5-6-10-20)12-18-13-22(30-2)23(31-3)14-21(18)27-24/h12-14,17,20,26H,4-11,15-16H2,1-3H3/p+1/t17-/m0/s1