ethyl 5-[(4-chloranyl-3-nitro-phenyl)sulfonyl-(3-nitrophenyl)carbonyl-amino]-2-phenyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 5-[(4-chloranyl-3-nitro-phenyl)sulfonyl-(3-nitrophenyl)carbonyl-amino]-2-phenyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-[(4-chloro-3-nitro-phenyl)sulfonyl-(3-nitrobenzoyl)amino]-2-phenyl-benzofuran-3-carboxylate CAS Name: 5-[(4-chloro-3-nitrophenyl)sulfonyl-[(3-nitrophenyl)-oxomethyl]amino]-2-phenyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-chloro-3-nitrophenyl)sulfonyl-(3-nitrobenzoyl)amino]-2-phenyl-1-benzofuran-3-carboxylate Traditional Name: 5-[(4-chloro-3-nitro-phenyl)sulfonyl-(3-nitrobenzoyl)amino]-2-phenyl-benzofuran-3-carboxylic acid ethyl ester Formula: C30H20ClN3O10S MolecularWeight: 650.0119

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C=C(C=C2)N(C(=O)C3=CC(=CC=C3)[N+](=O)[O-])S(=O)(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C=C(C=C2)N(C(=O)C3=CC(=CC=C3)[N+](=O)[O-])S(=O)(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])C5=CC=CC=C5

InChI

InChI=1S/C30H20ClN3O10S/c1-2-43-30(36)27-23-16-20(11-14-26(23)44-28(27)18-7-4-3-5-8-18)32(29(35)19-9-6-10-21(15-19)33(37)38)45(41,42)22-12-13-24(31)25(17-22)34(39)40/h3-17H,2H2,1H3