ethyl 2-[[5-chloranyl-3-(2-chlorophenyl)-1-(3,4-dimethoxyphenyl)sulfonyl-3-oxidanyl-2H-indol-2-yl]carbonyl-ethyl-amino]propanoate

Systemtic Name: ethyl 2-[[5-chloranyl-3-(2-chlorophenyl)-1-(3,4-dimethoxyphenyl)sulfonyl-3-oxidanyl-2H-indol-2-yl]carbonyl-ethyl-amino]propanoate Openeye Name: ethyl 2-[[5-chloro-3-(2-chlorophenyl)-1-(3,4-dimethoxyphenyl)sulfonyl-3-hydroxy-indoline-2-carbonyl]-ethyl-amino]propanoate CAS Name: 2-[[[5-chloro-3-(2-chlorophenyl)-1-(3,4-dimethoxyphenyl)sulfonyl-3-hydroxy-2H-indol-2-yl]-oxomethyl]-ethylamino]propanoic acid ethyl ester IUPAC Name: ethyl 2-[[5-chloro-3-(2-chlorophenyl)-1-(3,4-dimethoxyphenyl)sulfonyl-3-hydroxy-2H-indole-2-carbonyl]-ethylamino]propanoate Traditional Name: 2-[[5-chloro-3-(2-chlorophenyl)-1-(3,4-dimethoxyphenyl)sulfonyl-3-hydroxy-indoline-2-carbonyl]-ethyl-amino]propionic acid ethyl ester Formula: C30H32Cl2N2O8S MolecularWeight: 651.55468

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(C)C(=O)OCC)C(=O)C1C(C2=C(N1S(=O)(=O)C3=CC(=C(C=C3)OC)OC)C=CC(=C2)Cl)(C4=CC=CC=C4Cl)O

Isomeric SMILES

CCN(C(C)C(=O)OCC)C(=O)C1C(C2=C(N1S(=O)(=O)C3=CC(=C(C=C3)OC)OC)C=CC(=C2)Cl)(C4=CC=CC=C4Cl)O

InChI

InChI=1S/C30H32Cl2N2O8S/c1-6-33(18(3)29(36)42-7-2)28(35)27-30(37,21-10-8-9-11-23(21)32)22-16-19(31)12-14-24(22)34(27)43(38,39)20-13-15-25(40-4)26(17-20)41-5/h8-18,27,37H,6-7H2,1-5H3