(8-methyl-2-pyrrolidin-1-yl-quinolin-1-ium-3-yl)methyl-[(3,4,5-trimethoxyphenyl)methyl]azanium

Systemtic Name: (8-methyl-2-pyrrolidin-1-yl-quinolin-1-ium-3-yl)methyl-[(3,4,5-trimethoxyphenyl)methyl]azanium Openeye Name: (8-methyl-2-pyrrolidin-1-yl-quinolin-1-ium-3-yl)methyl-[(3,4,5-trimethoxyphenyl)methyl]ammonium CAS Name: [8-methyl-2-(1-pyrrolidinyl)-3-quinolin-1-iumyl]methyl-[(3,4,5-trimethoxyphenyl)methyl]ammonium IUPAC Name: (8-methyl-2-pyrrolidin-1-ylquinolin-1-ium-3-yl)methyl-[(3,4,5-trimethoxyphenyl)methyl]azanium Traditional Name: (8-methyl-2-pyrrolidino-quinolin-1-ium-3-yl)methyl-(3,4,5-trimethoxybenzyl)ammonium Formula: C25H33N3O3+2 MolecularWeight: 423.54782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=CC(=C([NH+]=C12)N3CCCC3)C[NH2+]CC4=CC(=C(C(=C4)OC)OC)OC

Isomeric SMILES

CC1=CC=CC2=CC(=C([NH+]=C12)N3CCCC3)C[NH2+]CC4=CC(=C(C(=C4)OC)OC)OC

InChI

InChI=1S/C25H31N3O3/c1-17-8-7-9-19-14-20(25(27-23(17)19)28-10-5-6-11-28)16-26-15-18-12-21(29-2)24(31-4)22(13-18)30-3/h7-9,12-14,26H,5-6,10-11,15-16H2,1-4H3/p+2