3-[bis(azanyl)methylideneamino]propyl 4-oxidanylbenzoate

Systemtic Name: 3-[bis(azanyl)methylideneamino]propyl 4-oxidanylbenzoate Openeye Name: 3-guanidinopropyl 4-hydroxybenzoate CAS Name: 4-hydroxybenzoic acid 3-(diaminomethylideneamino)propyl ester IUPAC Name: 3-(diaminomethylideneamino)propyl 4-hydroxybenzoate Traditional Name: 4-hydroxybenzoic acid 3-guanidinopropyl ester Formula: C11H15N3O3 MolecularWeight: 237.2551

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCCCN=C(N)N)O

Isomeric SMILES

C1=CC(=CC=C1C(=O)OCCCN=C(N)N)O

InChI

InChI=1S/C11H15N3O3/c12-11(13)14-6-1-7-17-10(16)8-2-4-9(15)5-3-8/h2-5,15H,1,6-7H2,(H4,12,13,14)