3-[3-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]-3-oxidanylidene-propyl]-7-methoxy-4-methyl-chromen-2-one

Systemtic Name: 3-[3-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]-3-oxidanylidene-propyl]-7-methoxy-4-methyl-chromen-2-one Openeye Name: 3-[3-[4-(4-fluorobenzoyl)piperazin-1-yl]-3-oxo-propyl]-7-methoxy-4-methyl-chromen-2-one CAS Name: 3-[3-[4-[(4-fluorophenyl)-oxomethyl]-1-piperazinyl]-3-oxopropyl]-7-methoxy-4-methyl-1-benzopyran-2-one IUPAC Name: 3-[3-[4-(4-fluorobenzoyl)piperazin-1-yl]-3-oxopropyl]-7-methoxy-4-methylchromen-2-one Traditional Name: 3-[3-[4-(4-fluorobenzoyl)piperazino]-3-keto-propyl]-7-methoxy-4-methyl-coumarin Formula: C25H25FN2O5 MolecularWeight: 452.474803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)N3CCN(CC3)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)N3CCN(CC3)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H25FN2O5/c1-16-20-8-7-19(32-2)15-22(20)33-25(31)21(16)9-10-23(29)27-11-13-28(14-12-27)24(30)17-3-5-18(26)6-4-17/h3-8,15H,9-14H2,1-2H3