2-[[4-[(6-chloranylpyridin-3-yl)methoxy]-3-methoxy-phenyl]methylazaniumyl]ethyl-diethyl-azanium

Systemtic Name: 2-[[4-[(6-chloranylpyridin-3-yl)methoxy]-3-methoxy-phenyl]methylazaniumyl]ethyl-diethyl-azanium Openeye Name: 2-[[4-[(6-chloro-3-pyridyl)methoxy]-3-methoxy-phenyl]methylammonio]ethyl-diethyl-ammonium CAS Name: 2-[[4-[(6-chloro-3-pyridinyl)methoxy]-3-methoxyphenyl]methylammonio]ethyl-diethylammonium IUPAC Name: 2-[[4-[(6-chloropyridin-3-yl)methoxy]-3-methoxyphenyl]methylazaniumyl]ethyl-diethylazanium Traditional Name: 2-[[4-[(6-chloro-3-pyridyl)methoxy]-3-methoxy-benzyl]ammonio]ethyl-diethyl-ammonium Formula: C20H30ClN3O2+2 MolecularWeight: 379.9241

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC[NH2+]CC1=CC(=C(C=C1)OCC2=CN=C(C=C2)Cl)OC

Isomeric SMILES

CC[NH+](CC)CC[NH2+]CC1=CC(=C(C=C1)OCC2=CN=C(C=C2)Cl)OC

InChI

InChI=1S/C20H28ClN3O2/c1-4-24(5-2)11-10-22-13-16-6-8-18(19(12-16)25-3)26-15-17-7-9-20(21)23-14-17/h6-9,12,14,22H,4-5,10-11,13,15H2,1-3H3/p+2