2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]carbonylchromen-4-one

Systemtic Name: 2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]carbonylchromen-4-one Openeye Name: 2-[4-(p-tolylsulfonyl)piperazine-1-carbonyl]chromen-4-one CAS Name: 2-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-oxomethyl]-1-benzopyran-4-one IUPAC Name: 2-[4-(4-methylphenyl)sulfonylpiperazine-1-carbonyl]chromen-4-one Traditional Name: 2-(4-tosylpiperazine-1-carbonyl)chromone Formula: C21H20N2O5S MolecularWeight: 412.4589

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=O)C4=CC=CC=C4O3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=O)C4=CC=CC=C4O3

InChI

InChI=1S/C21H20N2O5S/c1-15-6-8-16(9-7-15)29(26,27)23-12-10-22(11-13-23)21(25)20-14-18(24)17-4-2-3-5-19(17)28-20/h2-9,14H,10-13H2,1H3