1-[7-[2-(2-methylphenyl)pyrrolidin-1-yl]sulfonyl-2,3-dihydro-1,4-benzoxazin-4-yl]ethanone

Systemtic Name: 1-[7-[2-(2-methylphenyl)pyrrolidin-1-yl]sulfonyl-2,3-dihydro-1,4-benzoxazin-4-yl]ethanone Openeye Name: 1-[7-[2-(o-tolyl)pyrrolidin-1-yl]sulfonyl-2,3-dihydro-1,4-benzoxazin-4-yl]ethanone CAS Name: 1-[7-[[2-(2-methylphenyl)-1-pyrrolidinyl]sulfonyl]-2,3-dihydro-1,4-benzoxazin-4-yl]ethanone IUPAC Name: 1-[7-[2-(2-methylphenyl)pyrrolidin-1-yl]sulfonyl-2,3-dihydro-1,4-benzoxazin-4-yl]ethanone Traditional Name: 1-[7-[2-(o-tolyl)pyrrolidino]sulfonyl-2,3-dihydro-1,4-benzoxazin-4-yl]ethanone Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2CCCN2S(=O)(=O)C3=CC4=C(C=C3)N(CCO4)C(=O)C

Isomeric SMILES

CC1=CC=CC=C1C2CCCN2S(=O)(=O)C3=CC4=C(C=C3)N(CCO4)C(=O)C

InChI

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