4-[bis(azanyl)methylideneamino]-3-(4-chlorophenyl)butanoic acid

Systemtic Name: 4-[bis(azanyl)methylideneamino]-3-(4-chlorophenyl)butanoic acid Openeye Name: 3-(4-chlorophenyl)-4-guanidino-butanoic acid CAS Name: 3-(4-chlorophenyl)-4-(diaminomethylideneamino)butanoic acid IUPAC Name: 3-(4-chlorophenyl)-4-(diaminomethylideneamino)butanoic acid Traditional Name: 3-(4-chlorophenyl)-4-guanidino-butyric acid Formula: C11H14ClN3O2 MolecularWeight: 255.70076

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(CC(=O)O)CN=C(N)N)Cl

Isomeric SMILES

C1=CC(=CC=C1C(CC(=O)O)CN=C(N)N)Cl

InChI

InChI=1S/C11H14ClN3O2/c12-9-3-1-7(2-4-9)8(5-10(16)17)6-15-11(13)14/h1-4,8H,5-6H2,(H,16,17)(H4,13,14,15)