(3-oxidanylidene-1,2-dihydropyrrolo[1,2-a]indol-6-yl) 4-methylbenzenesulfonate

Systemtic Name: (3-oxidanylidene-1,2-dihydropyrrolo[1,2-a]indol-6-yl) 4-methylbenzenesulfonate Openeye Name: (3-oxo-1,2-dihydropyrrolo[1,2-a]indol-6-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (3-oxo-1,2-dihydropyrrolo[1,2-a]indol-6-yl) ester IUPAC Name: (3-oxo-1,2-dihydropyrrolo[1,2-a]indol-6-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (3-keto-1,2-dihydropyrrol[1,2-a]indol-6-yl) ester Formula: C18H15NO4S MolecularWeight: 341.381

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)N4CCC(=O)C4=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)N4CCC(=O)C4=C3

InChI

InChI=1S/C18H15NO4S/c1-12-2-5-15(6-3-12)24(21,22)23-14-4-7-16-13(10-14)11-17-18(20)8-9-19(16)17/h2-7,10-11H,8-9H2,1H3