[4-[2-(dimethylamino)-2-oxidanylidene-ethoxy]-3-ethoxy-phenyl]methyl-(1-methylpiperidin-1-ium-4-yl)azanium

Systemtic Name: [4-[2-(dimethylamino)-2-oxidanylidene-ethoxy]-3-ethoxy-phenyl]methyl-(1-methylpiperidin-1-ium-4-yl)azanium Openeye Name: [4-[2-(dimethylamino)-2-oxo-ethoxy]-3-ethoxy-phenyl]methyl-(1-methylpiperidin-1-ium-4-yl)ammonium CAS Name: [4-[2-(dimethylamino)-2-oxoethoxy]-3-ethoxyphenyl]methyl-(1-methyl-4-piperidin-1-iumyl)ammonium IUPAC Name: [4-[2-(dimethylamino)-2-oxoethoxy]-3-ethoxyphenyl]methyl-(1-methylpiperidin-1-ium-4-yl)azanium Traditional Name: [4-[2-(dimethylamino)-2-keto-ethoxy]-3-ethoxy-benzyl]-(1-methylpiperidin-1-ium-4-yl)ammonium Formula: C19H33N3O3+2 MolecularWeight: 351.48362

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH2+]C2CC[NH+](CC2)C)OCC(=O)N(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH2+]C2CC[NH+](CC2)C)OCC(=O)N(C)C

InChI

InChI=1S/C19H31N3O3/c1-5-24-18-12-15(13-20-16-8-10-22(4)11-9-16)6-7-17(18)25-14-19(23)21(2)3/h6-7,12,16,20H,5,8-11,13-14H2,1-4H3/p+2