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

Systemtic Name: [4-[2-(tert-butylamino)-2-oxidanylidene-ethoxy]-3-methoxy-phenyl]methyl-(phenylmethyl)azanium Openeye Name: benzyl-[[4-[2-(tert-butylamino)-2-oxo-ethoxy]-3-methoxy-phenyl]methyl]ammonium CAS Name: [4-[2-(tert-butylamino)-2-oxoethoxy]-3-methoxyphenyl]methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[[4-[2-(tert-butylamino)-2-oxoethoxy]-3-methoxyphenyl]methyl]azanium Traditional Name: benzyl-[4-[2-(tert-butylamino)-2-keto-ethoxy]-3-methoxy-benzyl]ammonium Formula: C21H29N2O3+ MolecularWeight: 357.46656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)COC1=C(C=C(C=C1)C[NH2+]CC2=CC=CC=C2)OC

Isomeric SMILES

CC(C)(C)NC(=O)COC1=C(C=C(C=C1)C[NH2+]CC2=CC=CC=C2)OC

InChI

InChI=1S/C21H28N2O3/c1-21(2,3)23-20(24)15-26-18-11-10-17(12-19(18)25-4)14-22-13-16-8-6-5-7-9-16/h5-12,22H,13-15H2,1-4H3,(H,23,24)/p+1