3-[bis(azanyl)methylideneamino]propyl 2-oxidanylbenzoate; methane

Systemtic Name: 3-[bis(azanyl)methylideneamino]propyl 2-oxidanylbenzoate; methane Openeye Name: 3-guanidinopropyl 2-hydroxybenzoate; methane CAS Name: 2-hydroxybenzoic acid 3-(diaminomethylideneamino)propyl ester; methane IUPAC Name: 3-(diaminomethylideneamino)propyl 2-hydroxybenzoate; methane Traditional Name: 2-hydroxybenzoic acid 3-guanidinopropyl ester; methane Formula: C12H19N3O3 MolecularWeight: 253.29756

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H15N3O3.CH4/c12-11(13)14-6-3-7-17-10(16)8-4-1-2-5-9(8)15;/h1-2,4-5,15H,3,6-7H2,(H4,12,13,14);1H4