2-[5-[carbamimidoyl(methyl)amino]pentyl]benzoate

Systemtic Name: 2-[5-[carbamimidoyl(methyl)amino]pentyl]benzoate Openeye Name: 2-[5-[carbamimidoyl(methyl)amino]pentyl]benzoate CAS Name: 2-[5-[carbamimidoyl(methyl)amino]pentyl]benzoate IUPAC Name: 2-[5-[carbamimidoyl(methyl)amino]pentyl]benzoate Traditional Name: 2-[5-[amidino(methyl)amino]pentyl]benzoate Formula: C14H20N3O2- MolecularWeight: 262.3275

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCCCC1=CC=CC=C1C(=O)[O-])C(=N)N

Isomeric SMILES

CN(CCCCCC1=CC=CC=C1C(=O)[O-])C(=N)N

InChI

InChI=1S/C14H21N3O2/c1-17(14(15)16)10-6-2-3-7-11-8-4-5-9-12(11)13(18)19/h4-5,8-9H,2-3,6-7,10H2,1H3,(H3,15,16)(H,18,19)/p-1