2-methyl-4-[2-[3-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-oxidanylidene-ethyl]-1,4-benzoxazepine-3,5-dione

Systemtic Name: 2-methyl-4-[2-[3-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-oxidanylidene-ethyl]-1,4-benzoxazepine-3,5-dione Openeye Name: 2-methyl-4-[2-[3-[(4-methyl-1-piperidyl)sulfonyl]phenyl]-2-oxo-ethyl]-1,4-benzoxazepine-3,5-dione CAS Name: 2-methyl-4-[2-[3-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]-2-oxoethyl]-1,4-benzoxazepine-3,5-dione IUPAC Name: 2-methyl-4-[2-[3-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-oxoethyl]-1,4-benzoxazepine-3,5-dione Traditional Name: 4-[2-keto-2-[3-(4-methylpiperidino)sulfonylphenyl]ethyl]-2-methyl-1,4-benzoxazepine-3,5-quinone Formula: C24H26N2O6S MolecularWeight: 470.53804

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)CN3C(=O)C(OC4=CC=CC=C4C3=O)C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)CN3C(=O)C(OC4=CC=CC=C4C3=O)C

InChI

InChI=1S/C24H26N2O6S/c1-16-10-12-25(13-11-16)33(30,31)19-7-5-6-18(14-19)21(27)15-26-23(28)17(2)32-22-9-4-3-8-20(22)24(26)29/h3-9,14,16-17H,10-13,15H2,1-2H3