6-ethyl-4-[(6-methyl-2-nitro-pyridin-3-yl)oxymethyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 6-ethyl-4-[(6-methyl-2-nitro-pyridin-3-yl)oxymethyl]-7-oxidanyl-chromen-2-one Openeye Name: 6-ethyl-7-hydroxy-4-[(6-methyl-2-nitro-3-pyridyl)oxymethyl]chromen-2-one CAS Name: 6-ethyl-7-hydroxy-4-[(6-methyl-2-nitro-3-pyridinyl)oxymethyl]-1-benzopyran-2-one IUPAC Name: 6-ethyl-7-hydroxy-4-[(6-methyl-2-nitropyridin-3-yl)oxymethyl]chromen-2-one Traditional Name: 6-ethyl-7-hydroxy-4-[(6-methyl-2-nitro-3-pyridyl)oxymethyl]coumarin Formula: C18H16N2O6 MolecularWeight: 356.32944

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)COC3=C(N=C(C=C3)C)[N+](=O)[O-])O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)COC3=C(N=C(C=C3)C)[N+](=O)[O-])O

InChI

InChI=1S/C18H16N2O6/c1-3-11-6-13-12(7-17(22)26-16(13)8-14(11)21)9-25-15-5-4-10(2)19-18(15)20(23)24/h4-8,21H,3,9H2,1-2H3