1-[1-(5-bromanyl-2-methoxy-phenyl)sulfonylpiperidin-4-yl]-8-methyl-4H-3,1-benzoxazin-2-one

Systemtic Name: 1-[1-(5-bromanyl-2-methoxy-phenyl)sulfonylpiperidin-4-yl]-8-methyl-4H-3,1-benzoxazin-2-one Openeye Name: 1-[1-(5-bromo-2-methoxy-phenyl)sulfonyl-4-piperidyl]-8-methyl-4H-3,1-benzoxazin-2-one CAS Name: 1-[1-(5-bromo-2-methoxyphenyl)sulfonyl-4-piperidinyl]-8-methyl-4H-3,1-benzoxazin-2-one IUPAC Name: 1-[1-(5-bromo-2-methoxyphenyl)sulfonylpiperidin-4-yl]-8-methyl-4H-3,1-benzoxazin-2-one Traditional Name: 1-[1-(5-bromo-2-methoxy-phenyl)sulfonyl-4-piperidyl]-8-methyl-4H-3,1-benzoxazin-2-one Formula: C21H23BrN2O5S MolecularWeight: 495.38672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23BrN2O5S/c1-14-4-3-5-15-13-29-21(25)24(20(14)15)17-8-10-23(11-9-17)30(26,27)19-12-16(22)6-7-18(19)28-2/h3-7,12,17H,8-11,13H2,1-2H3