[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl] 2-azanyl-5-iodanyl-benzoate

Systemtic Name: [2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl] 2-azanyl-5-iodanyl-benzoate Openeye Name: [2-(3-methylanilino)-2-oxo-ethyl] 2-amino-5-iodo-benzoate CAS Name: 2-amino-5-iodobenzoic acid [2-(3-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylanilino)-2-oxoethyl] 2-amino-5-iodobenzoate Traditional Name: 2-amino-5-iodo-benzoic acid [2-keto-2-(m-toluidino)ethyl] ester Formula: C16H15IN2O3 MolecularWeight: 410.20637

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15IN2O3/c1-10-3-2-4-12(7-10)19-15(20)9-22-16(21)13-8-11(17)5-6-14(13)18/h2-8H,9,18H2,1H3,(H,19,20)