methyl 2-azanyl-3-[4-[bis(azanyl)methylideneamino]phenyl]propanoate

Systemtic Name: methyl 2-azanyl-3-[4-[bis(azanyl)methylideneamino]phenyl]propanoate Openeye Name: methyl 2-amino-3-(4-guanidinophenyl)propanoate CAS Name: 2-amino-3-[4-(diaminomethylideneamino)phenyl]propanoic acid methyl ester IUPAC Name: methyl 2-amino-3-[4-(diaminomethylideneamino)phenyl]propanoate Traditional Name: 2-amino-3-(4-guanidinophenyl)propionic acid methyl ester Formula: C11H16N4O2 MolecularWeight: 236.27034

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)N=C(N)N)N

Isomeric SMILES

COC(=O)C(CC1=CC=C(C=C1)N=C(N)N)N

InChI

InChI=1S/C11H16N4O2/c1-17-10(16)9(12)6-7-2-4-8(5-3-7)15-11(13)14/h2-5,9H,6,12H2,1H3,(H4,13,14,15)