cyclooctyl-[[3-ethoxy-4-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethoxy]phenyl]methyl]azanium

Systemtic Name: cyclooctyl-[[3-ethoxy-4-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethoxy]phenyl]methyl]azanium Openeye Name: cyclooctyl-[[3-ethoxy-4-[2-(4-methoxyanilino)-2-oxo-ethoxy]phenyl]methyl]ammonium CAS Name: cyclooctyl-[[3-ethoxy-4-[2-(4-methoxyanilino)-2-oxoethoxy]phenyl]methyl]ammonium IUPAC Name: cyclooctyl-[[3-ethoxy-4-[2-(4-methoxyanilino)-2-oxoethoxy]phenyl]methyl]azanium Traditional Name: cyclooctyl-[3-ethoxy-4-[2-keto-2-(p-anisidino)ethoxy]benzyl]ammonium Formula: C26H37N2O4+ MolecularWeight: 441.58298

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH2+]C2CCCCCCC2)OCC(=O)NC3=CC=C(C=C3)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH2+]C2CCCCCCC2)OCC(=O)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C26H36N2O4/c1-3-31-25-17-20(18-27-21-9-7-5-4-6-8-10-21)11-16-24(25)32-19-26(29)28-22-12-14-23(30-2)15-13-22/h11-17,21,27H,3-10,18-19H2,1-2H3,(H,28,29)/p+1