3-(4-nitrophenyl)carbonyl-3,4-dihydrochromen-2-one

Systemtic Name: 3-(4-nitrophenyl)carbonyl-3,4-dihydrochromen-2-one Openeye Name: 3-(4-nitrobenzoyl)chroman-2-one CAS Name: 3-[(4-nitrophenyl)-oxomethyl]-3,4-dihydro-2H-1-benzopyran-2-one IUPAC Name: 3-(4-nitrobenzoyl)-3,4-dihydrochromen-2-one Traditional Name: 3-(4-nitrobenzoyl)chroman-2-one Formula: C16H11NO5 MolecularWeight: 297.26224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)OC2=CC=CC=C21)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1C(C(=O)OC2=CC=CC=C21)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H11NO5/c18-15(10-5-7-12(8-6-10)17(20)21)13-9-11-3-1-2-4-14(11)22-16(13)19/h1-8,13H,9H2