7-ethyl-4-[(2-nitropyridin-3-yl)oxymethyl]chromen-2-one

Systemtic Name: 7-ethyl-4-[(2-nitropyridin-3-yl)oxymethyl]chromen-2-one Openeye Name: 7-ethyl-4-[(2-nitro-3-pyridyl)oxymethyl]chromen-2-one CAS Name: 7-ethyl-4-[(2-nitro-3-pyridinyl)oxymethyl]-1-benzopyran-2-one IUPAC Name: 7-ethyl-4-[(2-nitropyridin-3-yl)oxymethyl]chromen-2-one Traditional Name: 7-ethyl-4-[(2-nitro-3-pyridyl)oxymethyl]coumarin Formula: C17H14N2O5 MolecularWeight: 326.30346

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC3=C(N=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC3=C(N=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H14N2O5/c1-2-11-5-6-13-12(9-16(20)24-15(13)8-11)10-23-14-4-3-7-18-17(14)19(21)22/h3-9H,2,10H2,1H3