N-[(7-methoxy-2-morpholin-4-yl-quinolin-1-ium-3-yl)methyl]-N-[[(2R)-oxolan-2-yl]methyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[(7-methoxy-2-morpholin-4-yl-quinolin-1-ium-3-yl)methyl]-N-[[(2R)-oxolan-2-yl]methyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(7-methoxy-2-morpholino-quinolin-1-ium-3-yl)methyl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[[7-methoxy-2-(4-morpholinyl)-3-quinolin-1-iumyl]methyl]-N-[[(2R)-2-oxolanyl]methyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(7-methoxy-2-morpholin-4-ylquinolin-1-ium-3-yl)methyl]-N-[[(2R)-oxolan-2-yl]methyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(7-methoxy-2-morpholino-quinolin-1-ium-3-yl)methyl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]-piperonylamide Formula: C28H32N3O6+ MolecularWeight: 506.57018

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=[NH+]C(=C(C=C2C=C1)CN(CC3CCCO3)C(=O)C4=CC5=C(C=C4)OCO5)N6CCOCC6

Isomeric SMILES

COC1=CC2=[NH+]C(=C(C=C2C=C1)CN(C[C@H]3CCCO3)C(=O)C4=CC5=C(C=C4)OCO5)N6CCOCC6

InChI

InChI=1S/C28H31N3O6/c1-33-22-6-4-19-13-21(27(29-24(19)15-22)30-8-11-34-12-9-30)16-31(17-23-3-2-10-35-23)28(32)20-5-7-25-26(14-20)37-18-36-25/h4-7,13-15,23H,2-3,8-12,16-18H2,1H3/p+1/t23-/m1/s1