[2-(4-ethoxycarbonylpiperidin-1-yl)-5,8-dimethoxy-quinolin-3-yl]methyl-[(1-oxidanylcyclohexyl)methyl]azanium

Systemtic Name: [2-(4-ethoxycarbonylpiperidin-1-yl)-5,8-dimethoxy-quinolin-3-yl]methyl-[(1-oxidanylcyclohexyl)methyl]azanium Openeye Name: [2-(4-ethoxycarbonyl-1-piperidyl)-5,8-dimethoxy-3-quinolyl]methyl-[(1-hydroxycyclohexyl)methyl]ammonium CAS Name: [2-(4-ethoxycarbonyl-1-piperidinyl)-5,8-dimethoxy-3-quinolinyl]methyl-[(1-hydroxycyclohexyl)methyl]ammonium IUPAC Name: [2-(4-ethoxycarbonylpiperidin-1-yl)-5,8-dimethoxyquinolin-3-yl]methyl-[(1-hydroxycyclohexyl)methyl]azanium Traditional Name: [2-(4-carbethoxypiperidino)-5,8-dimethoxy-3-quinolyl]methyl-[(1-hydroxycyclohexyl)methyl]ammonium Formula: C27H40N3O5+ MolecularWeight: 486.6236

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=NC3=C(C=CC(=C3C=C2C[NH2+]CC4(CCCCC4)O)OC)OC

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=NC3=C(C=CC(=C3C=C2C[NH2+]CC4(CCCCC4)O)OC)OC

InChI

InChI=1S/C27H39N3O5/c1-4-35-26(31)19-10-14-30(15-11-19)25-20(17-28-18-27(32)12-6-5-7-13-27)16-21-22(33-2)8-9-23(34-3)24(21)29-25/h8-9,16,19,28,32H,4-7,10-15,17-18H2,1-3H3/p+1