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

Systemtic Name: 4-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-7-methoxy-chromen-2-one Openeye Name: 4-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxo-ethyl]-7-methoxy-chromen-2-one CAS Name: 4-[2-[4-(3-chlorophenyl)-1-piperazinyl]-2-oxoethyl]-7-methoxy-1-benzopyran-2-one IUPAC Name: 4-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl]-7-methoxychromen-2-one Traditional Name: 4-[2-[4-(3-chlorophenyl)piperazino]-2-keto-ethyl]-7-methoxy-coumarin Formula: C22H21ClN2O4 MolecularWeight: 412.86614

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)CC(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)CC(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H21ClN2O4/c1-28-18-5-6-19-15(12-22(27)29-20(19)14-18)11-21(26)25-9-7-24(8-10-25)17-4-2-3-16(23)13-17/h2-6,12-14H,7-11H2,1H3