5-[bis(azanyl)methylideneamino]pentyl 2-oxidanylbenzoate; methane

Systemtic Name: 5-[bis(azanyl)methylideneamino]pentyl 2-oxidanylbenzoate; methane Openeye Name: 5-guanidinopentyl 2-hydroxybenzoate; methane CAS Name: 2-hydroxybenzoic acid 5-(diaminomethylideneamino)pentyl ester; methane IUPAC Name: 5-(diaminomethylideneamino)pentyl 2-hydroxybenzoate; methane Traditional Name: 2-hydroxybenzoic acid 5-guanidinopentyl ester; methane Formula: C14H23N3O3 MolecularWeight: 281.35072

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Descriptors Computed from Structure

Canonical SMILES:

C.C1=CC=C(C(=C1)C(=O)OCCCCCN=C(N)N)O

Isomeric SMILES

C.C1=CC=C(C(=C1)C(=O)OCCCCCN=C(N)N)O

InChI

InChI=1S/C13H19N3O3.CH4/c14-13(15)16-8-4-1-5-9-19-12(18)10-6-2-3-7-11(10)17;/h2-3,6-7,17H,1,4-5,8-9H2,(H4,14,15,16);1H4