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

Systemtic Name: 3-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]carbonyl-3,4-dihydroisochromen-1-one Openeye Name: 3-[4-[(3-chlorophenyl)methyl]piperazine-1-carbonyl]isochroman-1-one CAS Name: 3-[[4-[(3-chlorophenyl)methyl]-1-piperazinyl]-oxomethyl]-3,4-dihydro-1H-2-benzopyran-1-one IUPAC Name: 3-[4-[(3-chlorophenyl)methyl]piperazine-1-carbonyl]-3,4-dihydroisochromen-1-one Traditional Name: 3-[4-(3-chlorobenzyl)piperazine-1-carbonyl]isochroman-1-one Formula: C21H21ClN2O3 MolecularWeight: 384.85604

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=CC=C2)Cl)C(=O)C3CC4=CC=CC=C4C(=O)O3

Isomeric SMILES

C1CN(CCN1CC2=CC(=CC=C2)Cl)C(=O)C3CC4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C21H21ClN2O3/c22-17-6-3-4-15(12-17)14-23-8-10-24(11-9-23)20(25)19-13-16-5-1-2-7-18(16)21(26)27-19/h1-7,12,19H,8-11,13-14H2