ethyl 5-[(4-methoxy-3-nitro-phenyl)sulfonylamino]-2-phenyl-benzo[g][1]benzofuran-3-carboxylate

Systemtic Name: ethyl 5-[(4-methoxy-3-nitro-phenyl)sulfonylamino]-2-phenyl-benzo[g][1]benzofuran-3-carboxylate Openeye Name: ethyl 5-[(4-methoxy-3-nitro-phenyl)sulfonylamino]-2-phenyl-benzo[g]benzofuran-3-carboxylate CAS Name: 5-[(4-methoxy-3-nitrophenyl)sulfonylamino]-2-phenyl-3-benzo[g]benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-methoxy-3-nitrophenyl)sulfonylamino]-2-phenylbenzo[g][1]benzofuran-3-carboxylate Traditional Name: 5-[(4-methoxy-3-nitro-phenyl)sulfonylamino]-2-phenyl-benzo[g]benzofuran-3-carboxylic acid ethyl ester Formula: C28H22N2O8S MolecularWeight: 546.54788

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C=C(C3=CC=CC=C32)NS(=O)(=O)C4=CC(=C(C=C4)OC)[N+](=O)[O-])C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C=C(C3=CC=CC=C32)NS(=O)(=O)C4=CC(=C(C=C4)OC)[N+](=O)[O-])C5=CC=CC=C5

InChI

InChI=1S/C28H22N2O8S/c1-3-37-28(31)25-21-16-22(29-39(34,35)18-13-14-24(36-2)23(15-18)30(32)33)19-11-7-8-12-20(19)27(21)38-26(25)17-9-5-4-6-10-17/h4-16,29H,3H2,1-2H3