3-[azanyl-(4-methylphenyl)sulfonyl-methyl]cyclopentan-1-one

Systemtic Name: 3-[azanyl-(4-methylphenyl)sulfonyl-methyl]cyclopentan-1-one Openeye Name: 3-[amino(p-tolylsulfonyl)methyl]cyclopentanone CAS Name: 3-[amino-(4-methylphenyl)sulfonylmethyl]-1-cyclopentanone IUPAC Name: 3-[amino-(4-methylphenyl)sulfonylmethyl]cyclopentan-1-one Traditional Name: 3-[amino(tosyl)methyl]cyclopentanone Formula: C13H17NO3S MolecularWeight: 267.34398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(C2CCC(=O)C2)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(C2CCC(=O)C2)N

InChI

InChI=1S/C13H17NO3S/c1-9-2-6-12(7-3-9)18(16,17)13(14)10-4-5-11(15)8-10/h2-3,6-7,10,13H,4-5,8,14H2,1H3