9-chloranyl-6-(3-imidazol-1-ylpropyl)-3-nitro-indeno[1,2-c]isoquinoline-5,11-dione

Systemtic Name: 9-chloranyl-6-(3-imidazol-1-ylpropyl)-3-nitro-indeno[1,2-c]isoquinoline-5,11-dione Openeye Name: 9-chloro-6-(3-imidazol-1-ylpropyl)-3-nitro-indeno[1,2-c]isoquinoline-5,11-dione CAS Name: 9-chloro-6-[3-(1-imidazolyl)propyl]-3-nitroindeno[1,2-c]isoquinoline-5,11-dione IUPAC Name: 9-chloro-6-(3-imidazol-1-ylpropyl)-3-nitroindeno[1,2-c]isoquinoline-5,11-dione Traditional Name: 9-chloro-6-(3-imidazol-1-ylpropyl)-3-nitro-inden[1,2-c]isoquinoline-5,11-quinone Formula: C22H15ClN4O4 MolecularWeight: 434.8319

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)N(C3=C2C(=O)C4=C3C=CC(=C4)Cl)CCCN5C=CN=C5

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)N(C3=C2C(=O)C4=C3C=CC(=C4)Cl)CCCN5C=CN=C5

InChI

InChI=1S/C22H15ClN4O4/c23-13-2-4-16-17(10-13)21(28)19-15-5-3-14(27(30)31)11-18(15)22(29)26(20(16)19)8-1-7-25-9-6-24-12-25/h2-6,9-12H,1,7-8H2