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

Systemtic Name: [2-[(4-iodanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-phenylazanylbenzoate Openeye Name: [2-(4-iodo-2-methyl-anilino)-2-oxo-ethyl] 2-anilinobenzoate CAS Name: 2-anilinobenzoic acid [2-(4-iodo-2-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-iodo-2-methylanilino)-2-oxoethyl] 2-anilinobenzoate Traditional Name: 2-anilinobenzoic acid [2-(4-iodo-2-methyl-anilino)-2-keto-ethyl] ester Formula: C22H19IN2O3 MolecularWeight: 486.30233

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC(=O)COC(=O)C2=CC=CC=C2NC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC(=O)COC(=O)C2=CC=CC=C2NC3=CC=CC=C3

InChI

InChI=1S/C22H19IN2O3/c1-15-13-16(23)11-12-19(15)25-21(26)14-28-22(27)18-9-5-6-10-20(18)24-17-7-3-2-4-8-17/h2-13,24H,14H2,1H3,(H,25,26)