cyclooctyl-[2-[(4-iodanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: cyclooctyl-[2-[(4-iodanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: cyclooctyl-[2-(4-iodo-2-methyl-anilino)-2-oxo-ethyl]ammonium CAS Name: cyclooctyl-[2-(4-iodo-2-methylanilino)-2-oxoethyl]ammonium IUPAC Name: cyclooctyl-[2-(4-iodo-2-methylanilino)-2-oxoethyl]azanium Traditional Name: cyclooctyl-[2-(4-iodo-2-methyl-anilino)-2-keto-ethyl]ammonium Formula: C17H26IN2O+ MolecularWeight: 401.30561

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC(=O)C[NH2+]C2CCCCCCC2

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC(=O)C[NH2+]C2CCCCCCC2

InChI

InChI=1S/C17H25IN2O/c1-13-11-14(18)9-10-16(13)20-17(21)12-19-15-7-5-3-2-4-6-8-15/h9-11,15,19H,2-8,12H2,1H3,(H,20,21)/p+1