(4-morpholin-4-ylsulfonylphenyl)methyl 3-(3-oxidanylidene-4H-quinoxalin-2-yl)propanoate

Systemtic Name: (4-morpholin-4-ylsulfonylphenyl)methyl 3-(3-oxidanylidene-4H-quinoxalin-2-yl)propanoate Openeye Name: (4-morpholinosulfonylphenyl)methyl 3-(3-oxo-4H-quinoxalin-2-yl)propanoate CAS Name: 3-(3-oxo-4H-quinoxalin-2-yl)propanoic acid [4-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (4-morpholin-4-ylsulfonylphenyl)methyl 3-(3-oxo-4H-quinoxalin-2-yl)propanoate Traditional Name: 3-(3-keto-4H-quinoxalin-2-yl)propionic acid (4-morpholinosulfonylbenzyl) ester Formula: C22H23N3O6S MolecularWeight: 457.49952

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)COC(=O)CCC3=NC4=CC=CC=C4NC3=O

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)COC(=O)CCC3=NC4=CC=CC=C4NC3=O

InChI

InChI=1S/C22H23N3O6S/c26-21(10-9-20-22(27)24-19-4-2-1-3-18(19)23-20)31-15-16-5-7-17(8-6-16)32(28,29)25-11-13-30-14-12-25/h1-8H,9-15H2,(H,24,27)