[2-oxidanylidene-2-[(3-sulfamoylphenyl)amino]ethyl] 3-methoxy-4-(3-methylbutoxy)benzoate

Systemtic Name: [2-oxidanylidene-2-[(3-sulfamoylphenyl)amino]ethyl] 3-methoxy-4-(3-methylbutoxy)benzoate Openeye Name: [2-oxo-2-(3-sulfamoylanilino)ethyl] 4-isopentyloxy-3-methoxy-benzoate CAS Name: 3-methoxy-4-(3-methylbutoxy)benzoic acid [2-oxo-2-(3-sulfamoylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(3-sulfamoylanilino)ethyl] 3-methoxy-4-(3-methylbutoxy)benzoate Traditional Name: 4-isoamoxy-3-methoxy-benzoic acid [2-keto-2-(3-sulfamoylanilino)ethyl] ester Formula: C21H26N2O7S MolecularWeight: 450.50534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C(=O)OCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N)OC

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)C(=O)OCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N)OC

InChI

InChI=1S/C21H26N2O7S/c1-14(2)9-10-29-18-8-7-15(11-19(18)28-3)21(25)30-13-20(24)23-16-5-4-6-17(12-16)31(22,26)27/h4-8,11-12,14H,9-10,13H2,1-3H3,(H,23,24)(H2,22,26,27)