4,6-dinitro-5-[(phenylmethyl)amino]-1,3-dihydrobenzimidazol-2-one

Systemtic Name: 4,6-dinitro-5-[(phenylmethyl)amino]-1,3-dihydrobenzimidazol-2-one Openeye Name: 5-(benzylamino)-4,6-dinitro-1,3-dihydrobenzimidazol-2-one CAS Name: 4,6-dinitro-5-[(phenylmethyl)amino]-1,3-dihydrobenzimidazol-2-one IUPAC Name: 5-(benzylamino)-4,6-dinitro-1,3-dihydrobenzimidazol-2-one Traditional Name: 5-(benzylamino)-4,6-dinitro-1,3-dihydrobenzimidazol-2-one Formula: C14H11N5O5 MolecularWeight: 329.26764

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C=C3C(=C2[N+](=O)[O-])NC(=O)N3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C=C3C(=C2[N+](=O)[O-])NC(=O)N3)[N+](=O)[O-]

InChI

InChI=1S/C14H11N5O5/c20-14-16-9-6-10(18(21)22)12(13(19(23)24)11(9)17-14)15-7-8-4-2-1-3-5-8/h1-6,15H,7H2,(H2,16,17,20)