3-[(4-nitrophenyl)methyl]chromen-4-one

Systemtic Name: 3-[(4-nitrophenyl)methyl]chromen-4-one Openeye Name: 3-[(4-nitrophenyl)methyl]chromen-4-one CAS Name: 3-[(4-nitrophenyl)methyl]-1-benzopyran-4-one IUPAC Name: 3-[(4-nitrophenyl)methyl]chromen-4-one Traditional Name: 3-(4-nitrobenzyl)chromone Formula: C16H11NO4 MolecularWeight: 281.26284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(=CO2)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(=CO2)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H11NO4/c18-16-12(10-21-15-4-2-1-3-14(15)16)9-11-5-7-13(8-6-11)17(19)20/h1-8,10H,9H2