3-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]carbonyl-3,4-dihydroisochromen-1-one

Systemtic Name: 3-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]carbonyl-3,4-dihydroisochromen-1-one Openeye Name: 3-[4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazine-1-carbonyl]isochroman-1-one CAS Name: 3-[[4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazinyl]-oxomethyl]-3,4-dihydro-1H-2-benzopyran-1-one IUPAC Name: 3-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazine-1-carbonyl]-3,4-dihydroisochromen-1-one Traditional Name: 3-[4-(coumaran-5-ylmethyl)piperazine-1-carbonyl]isochroman-1-one Formula: C23H24N2O4 MolecularWeight: 392.44766

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)CN3CCN(CC3)C(=O)C4CC5=CC=CC=C5C(=O)O4

Isomeric SMILES

C1COC2=C1C=C(C=C2)CN3CCN(CC3)C(=O)C4CC5=CC=CC=C5C(=O)O4

InChI

InChI=1S/C23H24N2O4/c26-22(21-14-17-3-1-2-4-19(17)23(27)29-21)25-10-8-24(9-11-25)15-16-5-6-20-18(13-16)7-12-28-20/h1-6,13,21H,7-12,14-15H2