3-[4-[[bis(azanyl)methylideneamino]methyl]phenyl]propanoic acid

Systemtic Name: 3-[4-[[bis(azanyl)methylideneamino]methyl]phenyl]propanoic acid Openeye Name: 3-[4-(guanidinomethyl)phenyl]propanoic acid CAS Name: 3-[4-[(diaminomethylideneamino)methyl]phenyl]propanoic acid IUPAC Name: 3-[4-[(diaminomethylideneamino)methyl]phenyl]propanoic acid Traditional Name: 3-[4-(guanidinomethyl)phenyl]propionic acid Formula: C11H15N3O2 MolecularWeight: 221.2557

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(=O)O)CN=C(N)N

Isomeric SMILES

C1=CC(=CC=C1CCC(=O)O)CN=C(N)N

InChI

InChI=1S/C11H15N3O2/c12-11(13)14-7-9-3-1-8(2-4-9)5-6-10(15)16/h1-4H,5-7H2,(H,15,16)(H4,12,13,14)