1-[1-(2,4-dimethylphenyl)sulfonylpiperidin-4-yl]-4H-3,1-benzoxazin-2-one

Systemtic Name: 1-[1-(2,4-dimethylphenyl)sulfonylpiperidin-4-yl]-4H-3,1-benzoxazin-2-one Openeye Name: 1-[1-(2,4-dimethylphenyl)sulfonyl-4-piperidyl]-4H-3,1-benzoxazin-2-one CAS Name: 1-[1-(2,4-dimethylphenyl)sulfonyl-4-piperidinyl]-4H-3,1-benzoxazin-2-one IUPAC Name: 1-[1-(2,4-dimethylphenyl)sulfonylpiperidin-4-yl]-4H-3,1-benzoxazin-2-one Traditional Name: 1-[1-(2,4-dimethylphenyl)sulfonyl-4-piperidyl]-4H-3,1-benzoxazin-2-one Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)N3C4=CC=CC=C4COC3=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)N3C4=CC=CC=C4COC3=O)C

InChI

InChI=1S/C21H24N2O4S/c1-15-7-8-20(16(2)13-15)28(25,26)22-11-9-18(10-12-22)23-19-6-4-3-5-17(19)14-27-21(23)24/h3-8,13,18H,9-12,14H2,1-2H3