(1S,4R)-1-methyl-4-(4-methylpiperazin-1-yl)-1,4-dihydroisochromen-3-one dihydrochloride

Systemtic Name: (1S,4R)-1-methyl-4-(4-methylpiperazin-1-yl)-1,4-dihydroisochromen-3-one dihydrochloride Openeye Name: (1S,4R)-1-methyl-4-(4-methylpiperazin-1-yl)isochroman-3-one dihydrochloride CAS Name: (1S,4R)-1-methyl-4-(4-methyl-1-piperazinyl)-3,4-dihydro-1H-2-benzopyran-3-one dihydrochloride IUPAC Name: (1S,4R)-1-methyl-4-(4-methylpiperazin-1-yl)-1,4-dihydroisochromen-3-one dihydrochloride Traditional Name: (1S,4R)-1-methyl-4-(4-methylpiperazino)isochroman-3-one dihydrochloride Formula: C15H22Cl2N2O2 MolecularWeight: 333.25338

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC=CC=C2C(C(=O)O1)N3CCN(CC3)C.Cl.Cl

Isomeric SMILES

C[C@H]1C2=CC=CC=C2[C@H](C(=O)O1)N3CCN(CC3)C.Cl.Cl

InChI

InChI=1S/C15H20N2O2.2ClH/c1-11-12-5-3-4-6-13(12)14(15(18)19-11)17-9-7-16(2)8-10-17;;/h3-6,11,14H,7-10H2,1-2H3;2*1H/t11-,14+;;/m0../s1