7-[2-[4-[(4-fluorophenyl)methyl]-2,5-dimethyl-piperazin-1-yl]-2-oxidanylidene-ethoxy]-4-methyl-8-nitro-chromen-2-one

Systemtic Name: 7-[2-[4-[(4-fluorophenyl)methyl]-2,5-dimethyl-piperazin-1-yl]-2-oxidanylidene-ethoxy]-4-methyl-8-nitro-chromen-2-one Openeye Name: 7-[2-[4-[(4-fluorophenyl)methyl]-2,5-dimethyl-piperazin-1-yl]-2-oxo-ethoxy]-4-methyl-8-nitro-chromen-2-one CAS Name: 7-[2-[4-[(4-fluorophenyl)methyl]-2,5-dimethyl-1-piperazinyl]-2-oxoethoxy]-4-methyl-8-nitro-1-benzopyran-2-one IUPAC Name: 7-[2-[4-[(4-fluorophenyl)methyl]-2,5-dimethylpiperazin-1-yl]-2-oxoethoxy]-4-methyl-8-nitrochromen-2-one Traditional Name: 7-[2-[4-(4-fluorobenzyl)-2,5-dimethyl-piperazino]-2-keto-ethoxy]-4-methyl-8-nitro-coumarin Formula: C25H26FN3O6 MolecularWeight: 483.488843

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(CN1C(=O)COC2=C(C3=C(C=C2)C(=CC(=O)O3)C)[N+](=O)[O-])C)CC4=CC=C(C=C4)F

Isomeric SMILES

CC1CN(C(CN1C(=O)COC2=C(C3=C(C=C2)C(=CC(=O)O3)C)[N+](=O)[O-])C)CC4=CC=C(C=C4)F

InChI

InChI=1S/C25H26FN3O6/c1-15-10-23(31)35-25-20(15)8-9-21(24(25)29(32)33)34-14-22(30)28-12-16(2)27(11-17(28)3)13-18-4-6-19(26)7-5-18/h4-10,16-17H,11-14H2,1-3H3