4-chloranyl-3-nitro-N-[2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzamide

Systemtic Name: 4-chloranyl-3-nitro-N-[2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzamide Openeye Name: N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-chloro-3-nitro-benzamide CAS Name: N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-chloro-3-nitrobenzamide IUPAC Name: N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-chloro-3-nitrobenzamide Traditional Name: N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-chloro-3-nitro-benzamide Formula: C23H18ClN3O4 MolecularWeight: 435.85972

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H18ClN3O4/c24-20-9-7-17(13-21(20)27(30)31)22(28)25-19-8-6-15-10-11-26(14-18(15)12-19)23(29)16-4-2-1-3-5-16/h1-9,12-13H,10-11,14H2,(H,25,28)