7-methyl-4-[[4-(6-nitropyridin-3-yl)piperazin-1-yl]methyl]chromen-2-one

Systemtic Name: 7-methyl-4-[[4-(6-nitropyridin-3-yl)piperazin-1-yl]methyl]chromen-2-one Openeye Name: 7-methyl-4-[[4-(6-nitro-3-pyridyl)piperazin-1-yl]methyl]chromen-2-one CAS Name: 7-methyl-4-[[4-(6-nitro-3-pyridinyl)-1-piperazinyl]methyl]-1-benzopyran-2-one IUPAC Name: 7-methyl-4-[[4-(6-nitropyridin-3-yl)piperazin-1-yl]methyl]chromen-2-one Traditional Name: 7-methyl-4-[[4-(6-nitro-3-pyridyl)piperazino]methyl]coumarin Formula: C20H20N4O4 MolecularWeight: 380.3972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)CN3CCN(CC3)C4=CN=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)CN3CCN(CC3)C4=CN=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O4/c1-14-2-4-17-15(11-20(25)28-18(17)10-14)13-22-6-8-23(9-7-22)16-3-5-19(21-12-16)24(26)27/h2-5,10-12H,6-9,13H2,1H3