methanesulfonic acid; N-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-4-oxidanylidene-2,3-dihydrochromene-8-carboxamide

Systemtic Name: methanesulfonic acid; N-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-4-oxidanylidene-2,3-dihydrochromene-8-carboxamide Openeye Name: methanesulfonic acid; N-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-4-oxo-chromane-8-carboxamide CAS Name: methanesulfonic acid; N-[3-[4-(2-methoxyphenyl)-1-piperazinyl]propyl]-4-oxo-3,4-dihydro-2H-1-benzopyran-8-carboxamide IUPAC Name: methanesulfonic acid; N-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-4-oxo-2,3-dihydrochromene-8-carboxamide Traditional Name: 4-keto-N-[3-[4-(2-methoxyphenyl)piperazino]propyl]chroman-8-carboxamide; mesylic acid Formula: C25H33N3O7S MolecularWeight: 519.61042

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CCCNC(=O)C3=CC=CC4=C3OCCC4=O.CS(=O)(=O)O

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CCCNC(=O)C3=CC=CC4=C3OCCC4=O.CS(=O)(=O)O

InChI

InChI=1S/C24H29N3O4.CH4O3S/c1-30-22-9-3-2-8-20(22)27-15-13-26(14-16-27)12-5-11-25-24(29)19-7-4-6-18-21(28)10-17-31-23(18)19;1-5(2,3)4/h2-4,6-9H,5,10-17H2,1H3,(H,25,29);1H3,(H,2,3,4)