6-chloranyl-4-methyl-7-[2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxidanylidene-ethoxy]chromen-2-one

Systemtic Name: 6-chloranyl-4-methyl-7-[2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxidanylidene-ethoxy]chromen-2-one Openeye Name: 6-chloro-4-methyl-7-[2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxo-ethoxy]chromen-2-one CAS Name: 6-chloro-4-methyl-7-[2-[4-(4-nitrophenyl)-1-piperazinyl]-2-oxoethoxy]-1-benzopyran-2-one IUPAC Name: 6-chloro-4-methyl-7-[2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxoethoxy]chromen-2-one Traditional Name: 6-chloro-7-[2-keto-2-[4-(4-nitrophenyl)piperazino]ethoxy]-4-methyl-coumarin Formula: C22H20ClN3O6 MolecularWeight: 457.8637

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H20ClN3O6/c1-14-10-22(28)32-19-12-20(18(23)11-17(14)19)31-13-21(27)25-8-6-24(7-9-25)15-2-4-16(5-3-15)26(29)30/h2-5,10-12H,6-9,13H2,1H3