3,6-dinitro-4-phenyl-N-(phenylmethyl)quinolin-2-amine

Systemtic Name: 3,6-dinitro-4-phenyl-N-(phenylmethyl)quinolin-2-amine Openeye Name: N-benzyl-3,6-dinitro-4-phenyl-quinolin-2-amine CAS Name: 3,6-dinitro-4-phenyl-N-(phenylmethyl)-2-quinolinamine IUPAC Name: N-benzyl-3,6-dinitro-4-phenylquinolin-2-amine Traditional Name: benzyl-(3,6-dinitro-4-phenyl-2-quinolyl)amine Formula: C22H16N4O4 MolecularWeight: 400.38684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C(=C3C=C(C=CC3=N2)[N+](=O)[O-])C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C(=C3C=C(C=CC3=N2)[N+](=O)[O-])C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H16N4O4/c27-25(28)17-11-12-19-18(13-17)20(16-9-5-2-6-10-16)21(26(29)30)22(24-19)23-14-15-7-3-1-4-8-15/h1-13H,14H2,(H,23,24)