3-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4,8-dimethyl-7-oxidanyl-chromen-2-one

Systemtic Name: 3-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4,8-dimethyl-7-oxidanyl-chromen-2-one Openeye Name: 3-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxo-ethyl]-7-hydroxy-4,8-dimethyl-chromen-2-one CAS Name: 3-[2-[4-(3-chlorophenyl)-1-piperazinyl]-2-oxoethyl]-7-hydroxy-4,8-dimethyl-1-benzopyran-2-one IUPAC Name: 3-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl]-7-hydroxy-4,8-dimethylchromen-2-one Traditional Name: 3-[2-[4-(3-chlorophenyl)piperazino]-2-keto-ethyl]-7-hydroxy-4,8-dimethyl-coumarin Formula: C23H23ClN2O4 MolecularWeight: 426.89272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C)O)CC(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C)O)CC(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C23H23ClN2O4/c1-14-18-6-7-20(27)15(2)22(18)30-23(29)19(14)13-21(28)26-10-8-25(9-11-26)17-5-3-4-16(24)12-17/h3-7,12,27H,8-11,13H2,1-2H3