7-[4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-phenoxy]chromen-2-one

Systemtic Name: 7-[4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-phenoxy]chromen-2-one Openeye Name: 7-[4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-phenoxy]chromen-2-one CAS Name: 7-[4-[(4-methyl-1-piperazinyl)sulfonyl]-2-nitrophenoxy]-1-benzopyran-2-one IUPAC Name: 7-[4-(4-methylpiperazin-1-yl)sulfonyl-2-nitrophenoxy]chromen-2-one Traditional Name: 7-[4-(4-methylpiperazino)sulfonyl-2-nitro-phenoxy]coumarin Formula: C20H19N3O7S MolecularWeight: 445.44576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC3=CC4=C(C=C3)C=CC(=O)O4)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC3=CC4=C(C=C3)C=CC(=O)O4)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O7S/c1-21-8-10-22(11-9-21)31(27,28)16-5-6-18(17(13-16)23(25)26)29-15-4-2-14-3-7-20(24)30-19(14)12-15/h2-7,12-13H,8-11H2,1H3