N-(2-chloranyl-5-nitro-phenyl)-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzamide

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzamide CAS Name: N-(2-chloro-5-nitrophenyl)-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzamide Formula: C23H20ClN3O3 MolecularWeight: 421.8762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CC3=CC=C(C=C3)C(=O)NC4=C(C=CC(=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CC3=CC=C(C=C3)C(=O)NC4=C(C=CC(=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C23H20ClN3O3/c24-21-10-9-20(27(29)30)13-22(21)25-23(28)18-7-5-16(6-8-18)14-26-12-11-17-3-1-2-4-19(17)15-26/h1-10,13H,11-12,14-15H2,(H,25,28)