ethyl 2-chloranyl-5-[[4-[(3,4-dimethoxyphenyl)sulfonyl-methyl-amino]phenyl]carbonylamino]benzoate

Systemtic Name: ethyl 2-chloranyl-5-[[4-[(3,4-dimethoxyphenyl)sulfonyl-methyl-amino]phenyl]carbonylamino]benzoate Openeye Name: ethyl 2-chloro-5-[[4-[(3,4-dimethoxyphenyl)sulfonyl-methyl-amino]benzoyl]amino]benzoate CAS Name: 2-chloro-5-[[[4-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]phenyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-chloro-5-[[4-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]benzoyl]amino]benzoate Traditional Name: 2-chloro-5-[[4-[(3,4-dimethoxyphenyl)sulfonyl-methyl-amino]benzoyl]amino]benzoic acid ethyl ester Formula: C25H25ClN2O7S MolecularWeight: 532.9932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC(=C(C=C3)OC)OC)Cl

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC(=C(C=C3)OC)OC)Cl

InChI

InChI=1S/C25H25ClN2O7S/c1-5-35-25(30)20-14-17(8-12-21(20)26)27-24(29)16-6-9-18(10-7-16)28(2)36(31,32)19-11-13-22(33-3)23(15-19)34-4/h6-15H,5H2,1-4H3,(H,27,29)