[4-[[4-[2-(tert-butylamino)-2-oxidanylidene-ethoxy]-3-ethoxy-phenyl]methylazaniumyl]phenyl]-dimethyl-azanium

Systemtic Name: [4-[[4-[2-(tert-butylamino)-2-oxidanylidene-ethoxy]-3-ethoxy-phenyl]methylazaniumyl]phenyl]-dimethyl-azanium Openeye Name: [4-[[4-[2-(tert-butylamino)-2-oxo-ethoxy]-3-ethoxy-phenyl]methylammonio]phenyl]-dimethyl-ammonium CAS Name: [4-[[4-[2-(tert-butylamino)-2-oxoethoxy]-3-ethoxyphenyl]methylammonio]phenyl]-dimethylammonium IUPAC Name: [4-[[4-[2-(tert-butylamino)-2-oxoethoxy]-3-ethoxyphenyl]methylazaniumyl]phenyl]-dimethylazanium Traditional Name: [4-[[4-[2-(tert-butylamino)-2-keto-ethoxy]-3-ethoxy-benzyl]ammonio]phenyl]-dimethyl-ammonium Formula: C23H35N3O3+2 MolecularWeight: 401.5423

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH2+]C2=CC=C(C=C2)[NH+](C)C)OCC(=O)NC(C)(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH2+]C2=CC=C(C=C2)[NH+](C)C)OCC(=O)NC(C)(C)C

InChI

InChI=1S/C23H33N3O3/c1-7-28-21-14-17(15-24-18-9-11-19(12-10-18)26(5)6)8-13-20(21)29-16-22(27)25-23(2,3)4/h8-14,24H,7,15-16H2,1-6H3,(H,25,27)/p+2