[4-[2-(tert-butylamino)-2-oxidanylidene-ethoxy]-3-methoxy-phenyl]methyl-(2-dimethylaminoethyl)azanium

Systemtic Name: [4-[2-(tert-butylamino)-2-oxidanylidene-ethoxy]-3-methoxy-phenyl]methyl-(2-dimethylaminoethyl)azanium Openeye Name: [4-[2-(tert-butylamino)-2-oxo-ethoxy]-3-methoxy-phenyl]methyl-(2-dimethylaminoethyl)ammonium CAS Name: [4-[2-(tert-butylamino)-2-oxoethoxy]-3-methoxyphenyl]methyl-(2-dimethylaminoethyl)ammonium IUPAC Name: [4-[2-(tert-butylamino)-2-oxoethoxy]-3-methoxyphenyl]methyl-(2-dimethylaminoethyl)azanium Traditional Name: [4-[2-(tert-butylamino)-2-keto-ethoxy]-3-methoxy-benzyl]-(2-dimethylaminoethyl)ammonium Formula: C18H32N3O3+ MolecularWeight: 338.46498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)COC1=C(C=C(C=C1)C[NH2+]CCN(C)C)OC

Isomeric SMILES

CC(C)(C)NC(=O)COC1=C(C=C(C=C1)C[NH2+]CCN(C)C)OC

InChI

InChI=1S/C18H31N3O3/c1-18(2,3)20-17(22)13-24-15-8-7-14(11-16(15)23-6)12-19-9-10-21(4)5/h7-8,11,19H,9-10,12-13H2,1-6H3,(H,20,22)/p+1