[2-[(4-iodanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-phenyl-1,2,3,4-tetrahydroacridine-9-carboxylate

Systemtic Name: [2-[(4-iodanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-phenyl-1,2,3,4-tetrahydroacridine-9-carboxylate Openeye Name: [2-(4-iodo-2-methyl-anilino)-2-oxo-ethyl] 2-phenyl-1,2,3,4-tetrahydroacridine-9-carboxylate CAS Name: 2-phenyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid [2-(4-iodo-2-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-iodo-2-methylanilino)-2-oxoethyl] 2-phenyl-1,2,3,4-tetrahydroacridine-9-carboxylate Traditional Name: 2-phenyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid [2-(4-iodo-2-methyl-anilino)-2-keto-ethyl] ester Formula: C29H25IN2O3 MolecularWeight: 576.42487

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC(=O)COC(=O)C2=C3CC(CCC3=NC4=CC=CC=C42)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC(=O)COC(=O)C2=C3CC(CCC3=NC4=CC=CC=C42)C5=CC=CC=C5

InChI

InChI=1S/C29H25IN2O3/c1-18-15-21(30)12-14-24(18)32-27(33)17-35-29(34)28-22-9-5-6-10-25(22)31-26-13-11-20(16-23(26)28)19-7-3-2-4-8-19/h2-10,12,14-15,20H,11,13,16-17H2,1H3,(H,32,33)