3-[4-(3-cyclopentylpropanoyl)piperazin-1-yl]carbonyl-3,4-dihydroisochromen-1-one

Systemtic Name: 3-[4-(3-cyclopentylpropanoyl)piperazin-1-yl]carbonyl-3,4-dihydroisochromen-1-one Openeye Name: 3-[4-(3-cyclopentylpropanoyl)piperazine-1-carbonyl]isochroman-1-one CAS Name: 3-[[4-(3-cyclopentyl-1-oxopropyl)-1-piperazinyl]-oxomethyl]-3,4-dihydro-1H-2-benzopyran-1-one IUPAC Name: 3-[4-(3-cyclopentylpropanoyl)piperazine-1-carbonyl]-3,4-dihydroisochromen-1-one Traditional Name: 3-[4-(3-cyclopentylpropanoyl)piperazine-1-carbonyl]isochroman-1-one Formula: C22H28N2O4 MolecularWeight: 384.46872

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC(=O)N2CCN(CC2)C(=O)C3CC4=CC=CC=C4C(=O)O3

Isomeric SMILES

C1CCC(C1)CCC(=O)N2CCN(CC2)C(=O)C3CC4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C22H28N2O4/c25-20(10-9-16-5-1-2-6-16)23-11-13-24(14-12-23)21(26)19-15-17-7-3-4-8-18(17)22(27)28-19/h3-4,7-8,16,19H,1-2,5-6,9-15H2