2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 3-(cyclopropylsulfamoyl)-4-methoxy-benzoate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 3-(cyclopropylsulfamoyl)-4-methoxy-benzoate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 3-(cyclopropylsulfamoyl)-4-methoxy-benzoate CAS Name: 3-(cyclopropylsulfamoyl)-4-methoxybenzoic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 3-(cyclopropylsulfamoyl)-4-methoxybenzoate Traditional Name: 3-(cyclopropylsulfamoyl)-4-methoxy-benzoic acid 2-phthalimidoethyl ester Formula: C21H20N2O7S MolecularWeight: 444.4577

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OCCN2C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)NC4CC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OCCN2C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)NC4CC4

InChI

InChI=1S/C21H20N2O7S/c1-29-17-9-6-13(12-18(17)31(27,28)22-14-7-8-14)21(26)30-11-10-23-19(24)15-4-2-3-5-16(15)20(23)25/h2-6,9,12,14,22H,7-8,10-11H2,1H3