4-methyl-7-[[4-[4-(4-nitrophenyl)piperazin-1-yl]carbonylphenyl]methoxy]chromen-2-one

Systemtic Name: 4-methyl-7-[[4-[4-(4-nitrophenyl)piperazin-1-yl]carbonylphenyl]methoxy]chromen-2-one Openeye Name: 4-methyl-7-[[4-[4-(4-nitrophenyl)piperazine-1-carbonyl]phenyl]methoxy]chromen-2-one CAS Name: 4-methyl-7-[[4-[[4-(4-nitrophenyl)-1-piperazinyl]-oxomethyl]phenyl]methoxy]-1-benzopyran-2-one IUPAC Name: 4-methyl-7-[[4-[4-(4-nitrophenyl)piperazine-1-carbonyl]phenyl]methoxy]chromen-2-one Traditional Name: 4-methyl-7-[4-[4-(4-nitrophenyl)piperazine-1-carbonyl]benzyl]oxy-coumarin Formula: C28H25N3O6 MolecularWeight: 499.5146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OCC3=CC=C(C=C3)C(=O)N4CCN(CC4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OCC3=CC=C(C=C3)C(=O)N4CCN(CC4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C28H25N3O6/c1-19-16-27(32)37-26-17-24(10-11-25(19)26)36-18-20-2-4-21(5-3-20)28(33)30-14-12-29(13-15-30)22-6-8-23(9-7-22)31(34)35/h2-11,16-17H,12-15,18H2,1H3