4-chloranyl-3-(6-nitro-1,3-dihydrobenzo[de]isoquinolin-2-yl)benzoic acid

Systemtic Name: 4-chloranyl-3-(6-nitro-1,3-dihydrobenzo[de]isoquinolin-2-yl)benzoic acid Openeye Name: 4-chloro-3-(6-nitro-1,3-dihydrobenzo[de]isoquinolin-2-yl)benzoic acid CAS Name: 4-chloro-3-(6-nitro-1,3-dihydrobenzo[de]isoquinolin-2-yl)benzoic acid IUPAC Name: 4-chloro-3-(6-nitro-1,3-dihydrobenzo[de]isoquinolin-2-yl)benzoic acid Traditional Name: 4-chloro-3-(6-nitro-1,3-dihydrobenzo[de]isoquinolin-2-yl)benzoic acid Formula: C19H13ClN2O4 MolecularWeight: 368.77052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=C3C(=CC=CC3=C(C=C2)[N+](=O)[O-])CN1C4=C(C=CC(=C4)C(=O)O)Cl

Isomeric SMILES

C1C2=C3C(=CC=CC3=C(C=C2)[N+](=O)[O-])CN1C4=C(C=CC(=C4)C(=O)O)Cl

InChI

InChI=1S/C19H13ClN2O4/c20-15-6-4-11(19(23)24)8-17(15)21-9-12-2-1-3-14-16(22(25)26)7-5-13(10-21)18(12)14/h1-8H,9-10H2,(H,23,24)