7-[4-(4-methylphenyl)butoxy]-3-nitro-2-oxidanyl-chromen-4-one

Systemtic Name: 7-[4-(4-methylphenyl)butoxy]-3-nitro-2-oxidanyl-chromen-4-one Openeye Name: 2-hydroxy-3-nitro-7-[4-(p-tolyl)butoxy]chromen-4-one CAS Name: 2-hydroxy-7-[4-(4-methylphenyl)butoxy]-3-nitro-1-benzopyran-4-one IUPAC Name: 2-hydroxy-7-[4-(4-methylphenyl)butoxy]-3-nitrochromen-4-one Traditional Name: 2-hydroxy-3-nitro-7-[4-(p-tolyl)butoxy]chromone Formula: C20H19NO6 MolecularWeight: 369.36796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCCCOC2=CC3=C(C=C2)C(=O)C(=C(O3)O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CCCCOC2=CC3=C(C=C2)C(=O)C(=C(O3)O)[N+](=O)[O-]

InChI

InChI=1S/C20H19NO6/c1-13-5-7-14(8-6-13)4-2-3-11-26-15-9-10-16-17(12-15)27-20(23)18(19(16)22)21(24)25/h5-10,12,23H,2-4,11H2,1H3