(2,4-dinitrophenyl) 4-[bis(azanyl)methylideneamino]benzoate

Systemtic Name: (2,4-dinitrophenyl) 4-[bis(azanyl)methylideneamino]benzoate Openeye Name: (2,4-dinitrophenyl) 4-guanidinobenzoate CAS Name: 4-(diaminomethylideneamino)benzoic acid (2,4-dinitrophenyl) ester IUPAC Name: (2,4-dinitrophenyl) 4-(diaminomethylideneamino)benzoate Traditional Name: 4-guanidinobenzoic acid (2,4-dinitrophenyl) ester Formula: C14H11N5O6 MolecularWeight: 345.26704

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])N=C(N)N

Isomeric SMILES

C1=CC(=CC=C1C(=O)OC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])N=C(N)N

InChI

InChI=1S/C14H11N5O6/c15-14(16)17-9-3-1-8(2-4-9)13(20)25-12-6-5-10(18(21)22)7-11(12)19(23)24/h1-7H,(H4,15,16,17)