N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: N-[2-methoxy-5-(1-piperidylsulfonyl)phenyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: N-[2-methoxy-5-(1-piperidinylsulfonyl)phenyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-mesyl-N-(2-methoxy-5-piperidinosulfonyl-phenyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C22H27N3O7S2 MolecularWeight: 509.59568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3CN(C4=CC=CC=C4O3)S(=O)(=O)C

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3CN(C4=CC=CC=C4O3)S(=O)(=O)C

InChI

InChI=1S/C22H27N3O7S2/c1-31-19-11-10-16(34(29,30)24-12-6-3-7-13-24)14-17(19)23-22(26)21-15-25(33(2,27)28)18-8-4-5-9-20(18)32-21/h4-5,8-11,14,21H,3,6-7,12-13,15H2,1-2H3,(H,23,26)