4-methylsulfonyl-N-[[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: 4-methylsulfonyl-N-[[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 4-methylsulfonyl-N-[[3-(2-oxopyrrolidin-1-yl)phenyl]methyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 4-methylsulfonyl-N-[[3-(2-oxo-1-pyrrolidinyl)phenyl]methyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 4-methylsulfonyl-N-[[3-(2-oxopyrrolidin-1-yl)phenyl]methyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: N-[3-(2-ketopyrrolidino)benzyl]-4-mesyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CC(OC2=CC=CC=C21)C(=O)NCC3=CC(=CC=C3)N4CCCC4=O

Isomeric SMILES

CS(=O)(=O)N1CC(OC2=CC=CC=C21)C(=O)NCC3=CC(=CC=C3)N4CCCC4=O

InChI

InChI=1S/C21H23N3O5S/c1-30(27,28)24-14-19(29-18-9-3-2-8-17(18)24)21(26)22-13-15-6-4-7-16(12-15)23-11-5-10-20(23)25/h2-4,6-9,12,19H,5,10-11,13-14H2,1H3,(H,22,26)