4-[1-[(4-methylphenyl)methylsulfonyl]piperidin-4-yl]carbonyl-1,3-dihydroquinoxalin-2-one

Systemtic Name: 4-[1-[(4-methylphenyl)methylsulfonyl]piperidin-4-yl]carbonyl-1,3-dihydroquinoxalin-2-one Openeye Name: 4-[1-(p-tolylmethylsulfonyl)piperidine-4-carbonyl]-1,3-dihydroquinoxalin-2-one CAS Name: 4-[[1-[(4-methylphenyl)methylsulfonyl]-4-piperidinyl]-oxomethyl]-1,3-dihydroquinoxalin-2-one IUPAC Name: 4-[1-[(4-methylphenyl)methylsulfonyl]piperidine-4-carbonyl]-1,3-dihydroquinoxalin-2-one Traditional Name: 4-[1-(4-methylbenzyl)sulfonylisonipecotoyl]-1,3-dihydroquinoxalin-2-one Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CS(=O)(=O)N2CCC(CC2)C(=O)N3CC(=O)NC4=CC=CC=C43

Isomeric SMILES

CC1=CC=C(C=C1)CS(=O)(=O)N2CCC(CC2)C(=O)N3CC(=O)NC4=CC=CC=C43

InChI

InChI=1S/C22H25N3O4S/c1-16-6-8-17(9-7-16)15-30(28,29)24-12-10-18(11-13-24)22(27)25-14-21(26)23-19-4-2-3-5-20(19)25/h2-9,18H,10-15H2,1H3,(H,23,26)