[2-[4-(6-chloranyl-2,3-dihydroindol-1-yl)-6-methoxy-quinazolin-7-yl]oxy-1-oxidanyl-ethyl] methanesulfonate

Systemtic Name: [2-[4-(6-chloranyl-2,3-dihydroindol-1-yl)-6-methoxy-quinazolin-7-yl]oxy-1-oxidanyl-ethyl] methanesulfonate Openeye Name: [2-[4-(6-chloroindolin-1-yl)-6-methoxy-quinazolin-7-yl]oxy-1-hydroxy-ethyl] methanesulfonate CAS Name: methanesulfonic acid [2-[[4-(6-chloro-2,3-dihydroindol-1-yl)-6-methoxy-7-quinazolinyl]oxy]-1-hydroxyethyl] ester IUPAC Name: [2-[4-(6-chloro-2,3-dihydroindol-1-yl)-6-methoxyquinazolin-7-yl]oxy-1-hydroxyethyl] methanesulfonate Traditional Name: methanesulfonic acid [2-[4-(6-chloroindolin-1-yl)-6-methoxy-quinazolin-7-yl]oxy-1-hydroxy-ethyl] ester Formula: C20H20ClN3O6S MolecularWeight: 465.9073

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCC4=C3C=C(C=C4)Cl)OCC(O)OS(=O)(=O)C

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCC4=C3C=C(C=C4)Cl)OCC(O)OS(=O)(=O)C

InChI

InChI=1S/C20H20ClN3O6S/c1-28-17-8-14-15(9-18(17)29-10-19(25)30-31(2,26)27)22-11-23-20(14)24-6-5-12-3-4-13(21)7-16(12)24/h3-4,7-9,11,19,25H,5-6,10H2,1-2H3