ethyl 3-chloranyl-4-[2-[(4-iodophenyl)-(phenylsulfonyl)amino]ethanoylamino]benzoate

Systemtic Name: ethyl 3-chloranyl-4-[2-[(4-iodophenyl)-(phenylsulfonyl)amino]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[N-(benzenesulfonyl)-4-iodo-anilino]acetyl]amino]-3-chloro-benzoate CAS Name: 4-[[2-[N-(benzenesulfonyl)-4-iodoanilino]-1-oxoethyl]amino]-3-chlorobenzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[N-(benzenesulfonyl)-4-iodoanilino]acetyl]amino]-3-chlorobenzoate Traditional Name: 4-[[2-(N-besyl-4-iodo-anilino)acetyl]amino]-3-chloro-benzoic acid ethyl ester Formula: C23H20ClIN2O5S MolecularWeight: 598.83777

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)NC(=O)CN(C2=CC=C(C=C2)I)S(=O)(=O)C3=CC=CC=C3)Cl

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)NC(=O)CN(C2=CC=C(C=C2)I)S(=O)(=O)C3=CC=CC=C3)Cl

InChI

InChI=1S/C23H20ClIN2O5S/c1-2-32-23(29)16-8-13-21(20(24)14-16)26-22(28)15-27(18-11-9-17(25)10-12-18)33(30,31)19-6-4-3-5-7-19/h3-14H,2,15H2,1H3,(H,26,28)