1-[[4-(phenylmethyl)sulfonylpiperazin-1-yl]methyl]benzo[f]chromen-3-one

Systemtic Name: 1-[[4-(phenylmethyl)sulfonylpiperazin-1-yl]methyl]benzo[f]chromen-3-one Openeye Name: 1-[(4-benzylsulfonylpiperazin-1-yl)methyl]benzo[f]chromen-3-one CAS Name: 1-[[4-(phenylmethyl)sulfonyl-1-piperazinyl]methyl]-3-benzo[f][1]benzopyranone IUPAC Name: 1-[(4-benzylsulfonylpiperazin-1-yl)methyl]benzo[f]chromen-3-one Traditional Name: 1-[(4-benzylsulfonylpiperazino)methyl]benzo[f]chromen-3-one Formula: C25H24N2O4S MolecularWeight: 448.53406

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3)S(=O)(=O)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3)S(=O)(=O)CC5=CC=CC=C5

InChI

InChI=1S/C25H24N2O4S/c28-24-16-21(25-22-9-5-4-8-20(22)10-11-23(25)31-24)17-26-12-14-27(15-13-26)32(29,30)18-19-6-2-1-3-7-19/h1-11,16H,12-15,17-18H2