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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2CN(C3=CC=CC=C3O2)S(=O)(=O)C)S(=O)(=O)N4CCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2CN(C3=CC=CC=C3O2)S(=O)(=O)C)S(=O)(=O)N4CCCCC4

InChI

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