4-[(4-chlorophenyl)amino]-3,6-dinitro-chromen-2-one

Systemtic Name: 4-[(4-chlorophenyl)amino]-3,6-dinitro-chromen-2-one Openeye Name: 4-(4-chloroanilino)-3,6-dinitro-chromen-2-one CAS Name: 4-(4-chloroanilino)-3,6-dinitro-1-benzopyran-2-one IUPAC Name: 4-(4-chloroanilino)-3,6-dinitrochromen-2-one Traditional Name: 4-(4-chloroanilino)-3,6-dinitro-coumarin Formula: C15H8ClN3O6 MolecularWeight: 361.69352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=C(C(=O)OC3=C2C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1NC2=C(C(=O)OC3=C2C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])Cl

InChI

InChI=1S/C15H8ClN3O6/c16-8-1-3-9(4-2-8)17-13-11-7-10(18(21)22)5-6-12(11)25-15(20)14(13)19(23)24/h1-7,17H