4-[3-(azepan-1-ylsulfonyl)phenyl]carbonyl-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: 4-[3-(azepan-1-ylsulfonyl)phenyl]carbonyl-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 4-[3-(azepan-1-ylsulfonyl)benzoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 4-[[3-(1-azepanylsulfonyl)phenyl]-oxomethyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 4-[3-(azepan-1-ylsulfonyl)benzoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-[3-(azepan-1-ylsulfonyl)benzoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C23H27N3O5S MolecularWeight: 457.54258

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CN(C2=CC=CC=C2O1)C(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CNC(=O)C1CN(C2=CC=CC=C2O1)C(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C23H27N3O5S/c1-24-22(27)21-16-26(19-11-4-5-12-20(19)31-21)23(28)17-9-8-10-18(15-17)32(29,30)25-13-6-2-3-7-14-25/h4-5,8-12,15,21H,2-3,6-7,13-14,16H2,1H3,(H,24,27)