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

Systemtic Name: [4-(4-methylphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl]-(3-methylpiperidin-1-yl)methanone Openeye Name: (3-methyl-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]-(3-methyl-1-piperidinyl)methanone IUPAC Name: [4-(4-methylphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl]-(3-methylpiperidin-1-yl)methanone Traditional Name: (3-methylpiperidino)-(4-tosyl-2,3-dihydro-1,4-benzoxazin-2-yl)methanone Formula: C22H26N2O4S MolecularWeight: 414.51784

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C2CN(C3=CC=CC=C3O2)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CC1CCCN(C1)C(=O)C2CN(C3=CC=CC=C3O2)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C22H26N2O4S/c1-16-9-11-18(12-10-16)29(26,27)24-15-21(28-20-8-4-3-7-19(20)24)22(25)23-13-5-6-17(2)14-23/h3-4,7-12,17,21H,5-6,13-15H2,1-2H3