(4-nitrophenyl) 4-[carbamimidoyl(methyl)amino]benzoate

Systemtic Name: (4-nitrophenyl) 4-[carbamimidoyl(methyl)amino]benzoate Openeye Name: (4-nitrophenyl) 4-[carbamimidoyl(methyl)amino]benzoate CAS Name: 4-[carbamimidoyl(methyl)amino]benzoic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 4-[carbamimidoyl(methyl)amino]benzoate Traditional Name: 4-[amidino(methyl)amino]benzoic acid (4-nitrophenyl) ester Formula: C15H14N4O4 MolecularWeight: 314.29606

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14N4O4/c1-18(15(16)17)11-4-2-10(3-5-11)14(20)23-13-8-6-12(7-9-13)19(21)22/h2-9H,1H3,(H3,16,17)