2-[[2,4-bis(oxidanyl)phenyl]methylamino]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[[2,4-bis(oxidanyl)phenyl]methylamino]-5-nitro-benzenecarbonitrile Openeye Name: 2-[(2,4-dihydroxyphenyl)methylamino]-5-nitro-benzonitrile CAS Name: 2-[(2,4-dihydroxyphenyl)methylamino]-5-nitrobenzonitrile IUPAC Name: 2-[(2,4-dihydroxyphenyl)methylamino]-5-nitrobenzonitrile Traditional Name: 2-[(2,4-dihydroxybenzyl)amino]-5-nitro-benzonitrile Formula: C14H11N3O4 MolecularWeight: 285.25484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])C#N)NCC2=C(C=C(C=C2)O)O

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])C#N)NCC2=C(C=C(C=C2)O)O

InChI

InChI=1S/C14H11N3O4/c15-7-10-5-11(17(20)21)2-4-13(10)16-8-9-1-3-12(18)6-14(9)19/h1-6,16,18-19H,8H2