[4-(4-methylphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl]-piperidin-1-yl-methanone

Systemtic Name: [4-(4-methylphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl]-piperidin-1-yl-methanone Openeye Name: 1-piperidyl-[4-(p-tolylsulfonyl)-2,3-dihydro-1,4-benzoxazin-2-yl]methanone CAS Name: [4-(4-methylphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl]-(1-piperidinyl)methanone IUPAC Name: [4-(4-methylphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl]-piperidin-1-ylmethanone Traditional Name: piperidino-(4-tosyl-2,3-dihydro-1,4-benzoxazin-2-yl)methanone Formula: C21H24N2O4S MolecularWeight: 400.49126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC(OC3=CC=CC=C32)C(=O)N4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC(OC3=CC=CC=C32)C(=O)N4CCCCC4

InChI

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