(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 4-morpholin-4-ylsulfonylbenzoate

Systemtic Name: (7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 4-morpholin-4-ylsulfonylbenzoate Openeye Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl 4-morpholinosulfonylbenzoate CAS Name: 4-(4-morpholinylsulfonyl)benzoic acid (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl 4-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-morpholinosulfonylbenzoic acid (7-chloro-4-keto-1H-quinazolin-2-yl)methyl ester Formula: C20H18ClN3O6S MolecularWeight: 463.89142

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

InChI

InChI=1S/C20H18ClN3O6S/c21-14-3-6-16-17(11-14)22-18(23-19(16)25)12-30-20(26)13-1-4-15(5-2-13)31(27,28)24-7-9-29-10-8-24/h1-6,11H,7-10,12H2,(H,22,23,25)