6-chloranyl-7-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethoxy]-3,4-dimethyl-chromen-2-one

Systemtic Name: 6-chloranyl-7-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethoxy]-3,4-dimethyl-chromen-2-one Openeye Name: 6-chloro-7-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxo-ethoxy]-3,4-dimethyl-chromen-2-one CAS Name: 6-chloro-7-[2-[4-(4-fluorophenyl)-1-piperazinyl]-2-oxoethoxy]-3,4-dimethyl-1-benzopyran-2-one IUPAC Name: 6-chloro-7-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethoxy]-3,4-dimethylchromen-2-one Traditional Name: 6-chloro-7-[2-[4-(4-fluorophenyl)piperazino]-2-keto-ethoxy]-3,4-dimethyl-coumarin Formula: C23H22ClFN2O4 MolecularWeight: 444.883183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)N3CCN(CC3)C4=CC=C(C=C4)F)C

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)N3CCN(CC3)C4=CC=C(C=C4)F)C

InChI

InChI=1S/C23H22ClFN2O4/c1-14-15(2)23(29)31-20-12-21(19(24)11-18(14)20)30-13-22(28)27-9-7-26(8-10-27)17-5-3-16(25)4-6-17/h3-6,11-12H,7-10,13H2,1-2H3