[4-[2-(tert-butylamino)-2-oxidanylidene-ethoxy]-3-ethoxy-phenyl]methyl-[(1R)-1-phenylethyl]azanium

Systemtic Name: [4-[2-(tert-butylamino)-2-oxidanylidene-ethoxy]-3-ethoxy-phenyl]methyl-[(1R)-1-phenylethyl]azanium Openeye Name: [4-[2-(tert-butylamino)-2-oxo-ethoxy]-3-ethoxy-phenyl]methyl-[(1R)-1-phenylethyl]ammonium CAS Name: [4-[2-(tert-butylamino)-2-oxoethoxy]-3-ethoxyphenyl]methyl-[(1R)-1-phenylethyl]ammonium IUPAC Name: [4-[2-(tert-butylamino)-2-oxoethoxy]-3-ethoxyphenyl]methyl-[(1R)-1-phenylethyl]azanium Traditional Name: [4-[2-(tert-butylamino)-2-keto-ethoxy]-3-ethoxy-benzyl]-[(1R)-1-phenylethyl]ammonium Formula: C23H33N2O3+ MolecularWeight: 385.51972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H32N2O3/c1-6-27-21-14-18(15-24-17(2)19-10-8-7-9-11-19)12-13-20(21)28-16-22(26)25-23(3,4)5/h7-14,17,24H,6,15-16H2,1-5H3,(H,25,26)/p+1/t17-/m1/s1