6-ethyl-3-nitro-2-oxidanyl-7-(3-phenoxypropoxy)chromen-4-one

Systemtic Name: 6-ethyl-3-nitro-2-oxidanyl-7-(3-phenoxypropoxy)chromen-4-one Openeye Name: 6-ethyl-2-hydroxy-3-nitro-7-(3-phenoxypropoxy)chromen-4-one CAS Name: 6-ethyl-2-hydroxy-3-nitro-7-(3-phenoxypropoxy)-1-benzopyran-4-one IUPAC Name: 6-ethyl-2-hydroxy-3-nitro-7-(3-phenoxypropoxy)chromen-4-one Traditional Name: 6-ethyl-2-hydroxy-3-nitro-7-(3-phenoxypropoxy)chromone Formula: C20H19NO7 MolecularWeight: 385.36736

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)O)[N+](=O)[O-])OCCCOC3=CC=CC=C3

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)O)[N+](=O)[O-])OCCCOC3=CC=CC=C3

InChI

InChI=1S/C20H19NO7/c1-2-13-11-15-17(28-20(23)18(19(15)22)21(24)25)12-16(13)27-10-6-9-26-14-7-4-3-5-8-14/h3-5,7-8,11-12,23H,2,6,9-10H2,1H3