[4-[2-(tert-butylamino)-2-oxidanylidene-ethoxy]-3-ethoxy-phenyl]methyl-prop-2-enyl-azanium

Systemtic Name: [4-[2-(tert-butylamino)-2-oxidanylidene-ethoxy]-3-ethoxy-phenyl]methyl-prop-2-enyl-azanium Openeye Name: allyl-[[4-[2-(tert-butylamino)-2-oxo-ethoxy]-3-ethoxy-phenyl]methyl]ammonium CAS Name: [4-[2-(tert-butylamino)-2-oxoethoxy]-3-ethoxyphenyl]methyl-prop-2-enylammonium IUPAC Name: [4-[2-(tert-butylamino)-2-oxoethoxy]-3-ethoxyphenyl]methyl-prop-2-enylazanium Traditional Name: allyl-[4-[2-(tert-butylamino)-2-keto-ethoxy]-3-ethoxy-benzyl]ammonium Formula: C18H29N2O3+ MolecularWeight: 321.43446

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H28N2O3/c1-6-10-19-12-14-8-9-15(16(11-14)22-7-2)23-13-17(21)20-18(3,4)5/h6,8-9,11,19H,1,7,10,12-13H2,2-5H3,(H,20,21)/p+1