[6-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propoxy]-2-oxidanylidene-chromen-4-yl] methanesulfonate

Systemtic Name: [6-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propoxy]-2-oxidanylidene-chromen-4-yl] methanesulfonate Openeye Name: [6-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propoxy]-2-oxo-chromen-4-yl] methanesulfonate CAS Name: methanesulfonic acid [6-[3-[4-(4-methoxyphenyl)-1-piperazinyl]propoxy]-2-oxo-1-benzopyran-4-yl] ester IUPAC Name: [6-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propoxy]-2-oxochromen-4-yl] methanesulfonate Traditional Name: methanesulfonic acid [2-keto-6-[3-[4-(4-methoxyphenyl)piperazino]propoxy]chromen-4-yl] ester Formula: C24H28N2O7S MolecularWeight: 488.55332

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)CCCOC3=CC4=C(C=C3)OC(=O)C=C4OS(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)CCCOC3=CC4=C(C=C3)OC(=O)C=C4OS(=O)(=O)C

InChI

InChI=1S/C24H28N2O7S/c1-30-19-6-4-18(5-7-19)26-13-11-25(12-14-26)10-3-15-31-20-8-9-22-21(16-20)23(17-24(27)32-22)33-34(2,28)29/h4-9,16-17H,3,10-15H2,1-2H3