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

Systemtic Name: (1S,4R)-1-methyl-4-(4-phenylpiperazin-1-yl)-1,4-dihydroisochromen-3-one Openeye Name: (1S,4R)-1-methyl-4-(4-phenylpiperazin-1-yl)isochroman-3-one CAS Name: (1S,4R)-1-methyl-4-(4-phenyl-1-piperazinyl)-3,4-dihydro-1H-2-benzopyran-3-one IUPAC Name: (1S,4R)-1-methyl-4-(4-phenylpiperazin-1-yl)-1,4-dihydroisochromen-3-one Traditional Name: (1S,4R)-1-methyl-4-(4-phenylpiperazino)isochroman-3-one Formula: C20H22N2O2 MolecularWeight: 322.40088

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC=CC=C2C(C(=O)O1)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C[C@H]1C2=CC=CC=C2[C@H](C(=O)O1)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C20H22N2O2/c1-15-17-9-5-6-10-18(17)19(20(23)24-15)22-13-11-21(12-14-22)16-7-3-2-4-8-16/h2-10,15,19H,11-14H2,1H3/t15-,19+/m0/s1