1-[1-[4-(4-bromanylphenoxy)phenyl]sulfonylpiperidin-4-yl]-8-methyl-4H-3,1-benzoxazin-2-one

Systemtic Name: 1-[1-[4-(4-bromanylphenoxy)phenyl]sulfonylpiperidin-4-yl]-8-methyl-4H-3,1-benzoxazin-2-one Openeye Name: 1-[1-[4-(4-bromophenoxy)phenyl]sulfonyl-4-piperidyl]-8-methyl-4H-3,1-benzoxazin-2-one CAS Name: 1-[1-[4-(4-bromophenoxy)phenyl]sulfonyl-4-piperidinyl]-8-methyl-4H-3,1-benzoxazin-2-one IUPAC Name: 1-[1-[4-(4-bromophenoxy)phenyl]sulfonylpiperidin-4-yl]-8-methyl-4H-3,1-benzoxazin-2-one Traditional Name: 1-[1-[4-(4-bromophenoxy)phenyl]sulfonyl-4-piperidyl]-8-methyl-4H-3,1-benzoxazin-2-one Formula: C26H25BrN2O5S MolecularWeight: 557.4561

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N(C(=O)OC2)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)OC5=CC=C(C=C5)Br

Isomeric SMILES

CC1=CC=CC2=C1N(C(=O)OC2)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)OC5=CC=C(C=C5)Br

InChI

InChI=1S/C26H25BrN2O5S/c1-18-3-2-4-19-17-33-26(30)29(25(18)19)21-13-15-28(16-14-21)35(31,32)24-11-9-23(10-12-24)34-22-7-5-20(27)6-8-22/h2-12,21H,13-17H2,1H3