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

Systemtic Name: 3-[4-(phenylmethyl)sulfonylpiperazin-1-yl]carbonylchromen-2-one Openeye Name: 3-(4-benzylsulfonylpiperazine-1-carbonyl)chromen-2-one CAS Name: 3-[oxo-[4-(phenylmethyl)sulfonyl-1-piperazinyl]methyl]-1-benzopyran-2-one IUPAC Name: 3-(4-benzylsulfonylpiperazine-1-carbonyl)chromen-2-one Traditional Name: 3-(4-benzylsulfonylpiperazine-1-carbonyl)coumarin Formula: C21H20N2O5S MolecularWeight: 412.4589

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC3=CC=CC=C3OC2=O)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC3=CC=CC=C3OC2=O)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C21H20N2O5S/c24-20(18-14-17-8-4-5-9-19(17)28-21(18)25)22-10-12-23(13-11-22)29(26,27)15-16-6-2-1-3-7-16/h1-9,14H,10-13,15H2