3-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]carbonylchromen-2-one

Systemtic Name: 3-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]carbonylchromen-2-one Openeye Name: 3-[4-(4-tert-butylphenyl)sulfonylpiperazine-1-carbonyl]chromen-2-one CAS Name: 3-[[4-(4-tert-butylphenyl)sulfonyl-1-piperazinyl]-oxomethyl]-1-benzopyran-2-one IUPAC Name: 3-[4-(4-tert-butylphenyl)sulfonylpiperazine-1-carbonyl]chromen-2-one Traditional Name: 3-[4-(4-tert-butylphenyl)sulfonylpiperazine-1-carbonyl]coumarin Formula: C24H26N2O5S MolecularWeight: 454.53864

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H26N2O5S/c1-24(2,3)18-8-10-19(11-9-18)32(29,30)26-14-12-25(13-15-26)22(27)20-16-17-6-4-5-7-21(17)31-23(20)28/h4-11,16H,12-15H2,1-3H3