[2-oxidanylidene-2-[4-(phenylsulfonyl)piperazin-1-yl]ethyl] 1,4-bis(oxidanyl)naphthalene-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[4-(phenylsulfonyl)piperazin-1-yl]ethyl] 1,4-bis(oxidanyl)naphthalene-2-carboxylate Openeye Name: [2-[4-(benzenesulfonyl)piperazin-1-yl]-2-oxo-ethyl] 1,4-dihydroxynaphthalene-2-carboxylate CAS Name: 1,4-dihydroxy-2-naphthalenecarboxylic acid [2-[4-(benzenesulfonyl)-1-piperazinyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(benzenesulfonyl)piperazin-1-yl]-2-oxoethyl] 1,4-dihydroxynaphthalene-2-carboxylate Traditional Name: 1,4-dihydroxynaphthalene-2-carboxylic acid [2-(4-besylpiperazino)-2-keto-ethyl] ester Formula: C23H22N2O7S MolecularWeight: 470.49498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)COC(=O)C2=C(C3=CC=CC=C3C(=C2)O)O)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)COC(=O)C2=C(C3=CC=CC=C3C(=C2)O)O)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H22N2O7S/c26-20-14-19(22(28)18-9-5-4-8-17(18)20)23(29)32-15-21(27)24-10-12-25(13-11-24)33(30,31)16-6-2-1-3-7-16/h1-9,14,26,28H,10-13,15H2