[2-(cyclooctylamino)-2-oxidanylidene-ethyl] 4-iodanylbenzoate

Systemtic Name: [2-(cyclooctylamino)-2-oxidanylidene-ethyl] 4-iodanylbenzoate Openeye Name: [2-(cyclooctylamino)-2-oxo-ethyl] 4-iodobenzoate CAS Name: 4-iodobenzoic acid [2-(cyclooctylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclooctylamino)-2-oxoethyl] 4-iodobenzoate Traditional Name: 4-iodobenzoic acid [2-(cyclooctylamino)-2-keto-ethyl] ester Formula: C17H22INO3 MolecularWeight: 415.26595

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)COC(=O)C2=CC=C(C=C2)I

Isomeric SMILES

C1CCCC(CCC1)NC(=O)COC(=O)C2=CC=C(C=C2)I

InChI

InChI=1S/C17H22INO3/c18-14-10-8-13(9-11-14)17(21)22-12-16(20)19-15-6-4-2-1-3-5-7-15/h8-11,15H,1-7,12H2,(H,19,20)