3-fluoranyl-N-[(7-methoxy-2-pyrrolidin-1-yl-quinolin-1-ium-3-yl)methyl]-N-[[(2R)-oxolan-2-yl]methyl]benzamide

Systemtic Name: 3-fluoranyl-N-[(7-methoxy-2-pyrrolidin-1-yl-quinolin-1-ium-3-yl)methyl]-N-[[(2R)-oxolan-2-yl]methyl]benzamide Openeye Name: 3-fluoro-N-[(7-methoxy-2-pyrrolidin-1-yl-quinolin-1-ium-3-yl)methyl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]benzamide CAS Name: 3-fluoro-N-[[7-methoxy-2-(1-pyrrolidinyl)-3-quinolin-1-iumyl]methyl]-N-[[(2R)-2-oxolanyl]methyl]benzamide IUPAC Name: 3-fluoro-N-[(7-methoxy-2-pyrrolidin-1-ylquinolin-1-ium-3-yl)methyl]-N-[[(2R)-oxolan-2-yl]methyl]benzamide Traditional Name: 3-fluoro-N-[(7-methoxy-2-pyrrolidino-quinolin-1-ium-3-yl)methyl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]benzamide Formula: C27H31FN3O3+ MolecularWeight: 464.551743

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=[NH+]C(=C(C=C2C=C1)CN(CC3CCCO3)C(=O)C4=CC(=CC=C4)F)N5CCCC5

Isomeric SMILES

COC1=CC2=[NH+]C(=C(C=C2C=C1)CN(C[C@H]3CCCO3)C(=O)C4=CC(=CC=C4)F)N5CCCC5

InChI

InChI=1S/C27H30FN3O3/c1-33-23-10-9-19-14-21(26(29-25(19)16-23)30-11-2-3-12-30)17-31(18-24-8-5-13-34-24)27(32)20-6-4-7-22(28)15-20/h4,6-7,9-10,14-16,24H,2-3,5,8,11-13,17-18H2,1H3/p+1/t24-/m1/s1