1-[1-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonylpiperidin-4-yl]-4H-3,1-benzoxazin-2-one

Systemtic Name: 1-[1-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonylpiperidin-4-yl]-4H-3,1-benzoxazin-2-one Openeye Name: 1-[1-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-4-piperidyl]-4H-3,1-benzoxazin-2-one CAS Name: 1-[1-(4-methoxy-2,3,6-trimethylphenyl)sulfonyl-4-piperidinyl]-4H-3,1-benzoxazin-2-one IUPAC Name: 1-[1-(4-methoxy-2,3,6-trimethylphenyl)sulfonylpiperidin-4-yl]-4H-3,1-benzoxazin-2-one Traditional Name: 1-[1-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-4-piperidyl]-4H-3,1-benzoxazin-2-one Formula: C23H28N2O5S MolecularWeight: 444.54382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1S(=O)(=O)N2CCC(CC2)N3C4=CC=CC=C4COC3=O)C)C)OC

Isomeric SMILES

CC1=CC(=C(C(=C1S(=O)(=O)N2CCC(CC2)N3C4=CC=CC=C4COC3=O)C)C)OC

InChI

InChI=1S/C23H28N2O5S/c1-15-13-21(29-4)16(2)17(3)22(15)31(27,28)24-11-9-19(10-12-24)25-20-8-6-5-7-18(20)14-30-23(25)26/h5-8,13,19H,9-12,14H2,1-4H3