4-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-7-methyl-chromen-2-one

Systemtic Name: 4-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-7-methyl-chromen-2-one Openeye Name: 4-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxo-ethyl]-7-methyl-chromen-2-one CAS Name: 4-[2-[4-(3-chlorophenyl)-1-piperazinyl]-2-oxoethyl]-7-methyl-1-benzopyran-2-one IUPAC Name: 4-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl]-7-methylchromen-2-one Traditional Name: 4-[2-[4-(3-chlorophenyl)piperazino]-2-keto-ethyl]-7-methyl-coumarin Formula: C22H21ClN2O3 MolecularWeight: 396.86674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)CC(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)CC(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H21ClN2O3/c1-15-5-6-19-16(13-22(27)28-20(19)11-15)12-21(26)25-9-7-24(8-10-25)18-4-2-3-17(23)14-18/h2-6,11,13-14H,7-10,12H2,1H3