4-nitro-N2-(phenylmethyl)quinoline-2,3-diamine

Systemtic Name: 4-nitro-N2-(phenylmethyl)quinoline-2,3-diamine Openeye Name: N2-benzyl-4-nitro-quinoline-2,3-diamine CAS Name: 4-nitro-N2-(phenylmethyl)quinoline-2,3-diamine IUPAC Name: 2-N-benzyl-4-nitroquinoline-2,3-diamine Traditional Name: (3-amino-4-nitro-2-quinolyl)-benzyl-amine Formula: C16H14N4O2 MolecularWeight: 294.30796

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC3=CC=CC=C3C(=C2N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC3=CC=CC=C3C(=C2N)[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O2/c17-14-15(20(21)22)12-8-4-5-9-13(12)19-16(14)18-10-11-6-2-1-3-7-11/h1-9H,10,17H2,(H,18,19)