3-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]carbonylchromen-2-one

Systemtic Name: 3-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]carbonylchromen-2-one Openeye Name: 3-[4-(2,4-dimethylphenyl)sulfonylpiperazine-1-carbonyl]chromen-2-one CAS Name: 3-[[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]-oxomethyl]-1-benzopyran-2-one IUPAC Name: 3-[4-(2,4-dimethylphenyl)sulfonylpiperazine-1-carbonyl]chromen-2-one Traditional Name: 3-[4-(2,4-dimethylphenyl)sulfonylpiperazine-1-carbonyl]coumarin Formula: C22H22N2O5S MolecularWeight: 426.48548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4OC3=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4OC3=O)C

InChI

InChI=1S/C22H22N2O5S/c1-15-7-8-20(16(2)13-15)30(27,28)24-11-9-23(10-12-24)21(25)18-14-17-5-3-4-6-19(17)29-22(18)26/h3-8,13-14H,9-12H2,1-2H3