(phenylmethyl) 4-[[bis(azanyl)methylideneamino]methyl]benzoate

Systemtic Name: (phenylmethyl) 4-[[bis(azanyl)methylideneamino]methyl]benzoate Openeye Name: benzyl 4-(guanidinomethyl)benzoate CAS Name: 4-[(diaminomethylideneamino)methyl]benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[(diaminomethylideneamino)methyl]benzoate Traditional Name: 4-(guanidinomethyl)benzoic acid benzyl ester Formula: C16H17N3O2 MolecularWeight: 283.32508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)CN=C(N)N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)CN=C(N)N

InChI

InChI=1S/C16H17N3O2/c17-16(18)19-10-12-6-8-14(9-7-12)15(20)21-11-13-4-2-1-3-5-13/h1-9H,10-11H2,(H4,17,18,19)