7-[4,9-bis(oxidanylidene)pyrrolo[3,4-g]isoquinolin-2-yl]heptyl methanesulfonate

Systemtic Name: 7-[4,9-bis(oxidanylidene)pyrrolo[3,4-g]isoquinolin-2-yl]heptyl methanesulfonate Openeye Name: 7-(4,9-dioxopyrrolo[3,4-g]isoquinolin-2-yl)heptyl methanesulfonate CAS Name: methanesulfonic acid 7-(4,9-dioxo-2-pyrrolo[3,4-g]isoquinolinyl)heptyl ester IUPAC Name: 7-(4,9-dioxopyrrolo[3,4-g]isoquinolin-2-yl)heptyl methanesulfonate Traditional Name: methanesulfonic acid 7-(4,9-diketopyrrol[3,4-g]isoquinolin-2-yl)heptyl ester Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCCCCCCCN1C=C2C(=C1)C(=O)C3=C(C2=O)C=CN=C3

Isomeric SMILES

CS(=O)(=O)OCCCCCCCN1C=C2C(=C1)C(=O)C3=C(C2=O)C=CN=C3

InChI

InChI=1S/C19H22N2O5S/c1-27(24,25)26-10-6-4-2-3-5-9-21-12-16-17(13-21)19(23)15-11-20-8-7-14(15)18(16)22/h7-8,11-13H,2-6,9-10H2,1H3