tert-butyl 2-[2,4-dimethoxy-5-[(E)-3-oxidanylidene-3-(4-sulfamoylphenyl)prop-1-enyl]phenyl]indole-1-carboxylate

Systemtic Name: tert-butyl 2-[2,4-dimethoxy-5-[(E)-3-oxidanylidene-3-(4-sulfamoylphenyl)prop-1-enyl]phenyl]indole-1-carboxylate Openeye Name: tert-butyl 2-[2,4-dimethoxy-5-[(E)-3-oxo-3-(4-sulfamoylphenyl)prop-1-enyl]phenyl]indole-1-carboxylate CAS Name: 2-[2,4-dimethoxy-5-[(E)-3-oxo-3-(4-sulfamoylphenyl)prop-1-enyl]phenyl]-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[2,4-dimethoxy-5-[(E)-3-oxo-3-(4-sulfamoylphenyl)prop-1-enyl]phenyl]indole-1-carboxylate Traditional Name: 2-[5-[(E)-3-keto-3-(4-sulfamoylphenyl)prop-1-enyl]-2,4-dimethoxy-phenyl]indole-1-carboxylic acid tert-butyl ester Formula: C30H30N2O7S MolecularWeight: 562.6334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2=CC=CC=C2C=C1C3=CC(=C(C=C3OC)OC)C=CC(=O)C4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)N1C2=CC=CC=C2C=C1C3=CC(=C(C=C3OC)OC)/C=C/C(=O)C4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C30H30N2O7S/c1-30(2,3)39-29(34)32-24-9-7-6-8-20(24)17-25(32)23-16-21(27(37-4)18-28(23)38-5)12-15-26(33)19-10-13-22(14-11-19)40(31,35)36/h6-18H,1-5H3,(H2,31,35,36)/b15-12+