3-nitro-N-[(5-phenylisoquinolin-8-yl)methyl]benzamide

Systemtic Name: 3-nitro-N-[(5-phenylisoquinolin-8-yl)methyl]benzamide Openeye Name: 3-nitro-N-[(5-phenyl-8-isoquinolyl)methyl]benzamide CAS Name: 3-nitro-N-[(5-phenyl-8-isoquinolinyl)methyl]benzamide IUPAC Name: 3-nitro-N-[(5-phenylisoquinolin-8-yl)methyl]benzamide Traditional Name: 3-nitro-N-[(5-phenyl-8-isoquinolyl)methyl]benzamide Formula: C23H17N3O3 MolecularWeight: 383.39938

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=CN=CC3=C(C=C2)CNC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=CN=CC3=C(C=C2)CNC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H17N3O3/c27-23(17-7-4-8-19(13-17)26(28)29)25-14-18-9-10-20(16-5-2-1-3-6-16)21-11-12-24-15-22(18)21/h1-13,15H,14H2,(H,25,27)