4-methyl-7-[2-oxidanyl-3-(4-phenylpiperazin-1-yl)propoxy]chromen-2-one hydrochloride

Systemtic Name: 4-methyl-7-[2-oxidanyl-3-(4-phenylpiperazin-1-yl)propoxy]chromen-2-one hydrochloride Openeye Name: 7-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propoxy]-4-methyl-chromen-2-one hydrochloride CAS Name: 7-[2-hydroxy-3-(4-phenyl-1-piperazinyl)propoxy]-4-methyl-1-benzopyran-2-one hydrochloride IUPAC Name: 7-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propoxy]-4-methylchromen-2-one hydrochloride Traditional Name: 7-[2-hydroxy-3-(4-phenylpiperazino)propoxy]-4-methyl-coumarin hydrochloride Formula: C23H27ClN2O4 MolecularWeight: 430.92448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OCC(CN3CCN(CC3)C4=CC=CC=C4)O.Cl

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OCC(CN3CCN(CC3)C4=CC=CC=C4)O.Cl

InChI

InChI=1S/C23H26N2O4.ClH/c1-17-13-23(27)29-22-14-20(7-8-21(17)22)28-16-19(26)15-24-9-11-25(12-10-24)18-5-3-2-4-6-18;/h2-8,13-14,19,26H,9-12,15-16H2,1H3;1H