3-(dimethylazaniumyl)propyl-[(6-methoxy-2H-chromen-3-yl)methyl]-(pyridin-2-ylmethyl)azanium

Systemtic Name: 3-(dimethylazaniumyl)propyl-[(6-methoxy-2H-chromen-3-yl)methyl]-(pyridin-2-ylmethyl)azanium Openeye Name: 3-(dimethylammonio)propyl-[(6-methoxy-2H-chromen-3-yl)methyl]-(2-pyridylmethyl)ammonium CAS Name: 3-(dimethylammonio)propyl-[(6-methoxy-2H-1-benzopyran-3-yl)methyl]-(2-pyridinylmethyl)ammonium IUPAC Name: 3-(dimethylazaniumyl)propyl-[(6-methoxy-2H-chromen-3-yl)methyl]-(pyridin-2-ylmethyl)azanium Traditional Name: 3-(dimethylammonio)propyl-[(6-methoxy-2H-chromen-3-yl)methyl]-(2-pyridylmethyl)ammonium Formula: C22H31N3O2+2 MolecularWeight: 369.50044

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCC[NH+](CC1=CC2=C(C=CC(=C2)OC)OC1)CC3=CC=CC=N3

Isomeric SMILES

C[NH+](C)CCC[NH+](CC1=CC2=C(C=CC(=C2)OC)OC1)CC3=CC=CC=N3

InChI

InChI=1S/C22H29N3O2/c1-24(2)11-6-12-25(16-20-7-4-5-10-23-20)15-18-13-19-14-21(26-3)8-9-22(19)27-17-18/h4-5,7-10,13-14H,6,11-12,15-17H2,1-3H3/p+2