1-methyl-3-phenyl-4-(3-phenylmethoxypropoxy)-2-(piperidin-3-yloxymethyl)quinolin-1-ium

Systemtic Name: 1-methyl-3-phenyl-4-(3-phenylmethoxypropoxy)-2-(piperidin-3-yloxymethyl)quinolin-1-ium Openeye Name: 4-(3-benzyloxypropoxy)-1-methyl-3-phenyl-2-(3-piperidyloxymethyl)quinolin-1-ium CAS Name: 1-methyl-3-phenyl-4-(3-phenylmethoxypropoxy)-2-(3-piperidinyloxymethyl)quinolin-1-ium IUPAC Name: 1-methyl-3-phenyl-4-(3-phenylmethoxypropoxy)-2-(piperidin-3-yloxymethyl)quinolin-1-ium Traditional Name: 4-(3-benzoxypropoxy)-1-methyl-3-phenyl-2-(3-piperidyloxymethyl)quinolin-1-ium Formula: C32H37N2O3+ MolecularWeight: 497.64778

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C(=C(C2=CC=CC=C21)OCCCOCC3=CC=CC=C3)C4=CC=CC=C4)COC5CCCNC5

Isomeric SMILES

C[N+]1=C(C(=C(C2=CC=CC=C21)OCCCOCC3=CC=CC=C3)C4=CC=CC=C4)COC5CCCNC5

InChI

InChI=1S/C32H37N2O3/c1-34-29-18-9-8-17-28(29)32(36-21-11-20-35-23-25-12-4-2-5-13-25)31(26-14-6-3-7-15-26)30(34)24-37-27-16-10-19-33-22-27/h2-9,12-15,17-18,27,33H,10-11,16,19-24H2,1H3/q+1