[2-(cycloheptylamino)-2-oxidanylidene-ethyl] 3-iodanylbenzoate

Systemtic Name: [2-(cycloheptylamino)-2-oxidanylidene-ethyl] 3-iodanylbenzoate Openeye Name: [2-(cycloheptylamino)-2-oxo-ethyl] 3-iodobenzoate CAS Name: 3-iodobenzoic acid [2-(cycloheptylamino)-2-oxoethyl] ester IUPAC Name: [2-(cycloheptylamino)-2-oxoethyl] 3-iodobenzoate Traditional Name: 3-iodobenzoic acid [2-(cycloheptylamino)-2-keto-ethyl] ester Formula: C16H20INO3 MolecularWeight: 401.23937

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)COC(=O)C2=CC(=CC=C2)I

Isomeric SMILES

C1CCCC(CC1)NC(=O)COC(=O)C2=CC(=CC=C2)I

InChI

InChI=1S/C16H20INO3/c17-13-7-5-6-12(10-13)16(20)21-11-15(19)18-14-8-3-1-2-4-9-14/h5-7,10,14H,1-4,8-9,11H2,(H,18,19)