cyclohexyl-[[3-iodanyl-5-methoxy-4-[2-oxidanylidene-2-(phenethylamino)ethoxy]phenyl]methyl]azanium

Systemtic Name: cyclohexyl-[[3-iodanyl-5-methoxy-4-[2-oxidanylidene-2-(phenethylamino)ethoxy]phenyl]methyl]azanium Openeye Name: cyclohexyl-[[3-iodo-5-methoxy-4-[2-oxo-2-(phenethylamino)ethoxy]phenyl]methyl]ammonium CAS Name: cyclohexyl-[[3-iodo-5-methoxy-4-[2-oxo-2-(phenethylamino)ethoxy]phenyl]methyl]ammonium IUPAC Name: cyclohexyl-[[3-iodo-5-methoxy-4-[2-oxo-2-(phenethylamino)ethoxy]phenyl]methyl]azanium Traditional Name: cyclohexyl-[3-iodo-4-[2-keto-2-(phenethylamino)ethoxy]-5-methoxy-benzyl]ammonium Formula: C24H32IN2O3+ MolecularWeight: 523.42695

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C[NH2+]C2CCCCC2)I)OCC(=O)NCCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C(=CC(=C1)C[NH2+]C2CCCCC2)I)OCC(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C24H31IN2O3/c1-29-22-15-19(16-27-20-10-6-3-7-11-20)14-21(25)24(22)30-17-23(28)26-13-12-18-8-4-2-5-9-18/h2,4-5,8-9,14-15,20,27H,3,6-7,10-13,16-17H2,1H3,(H,26,28)/p+1