2-azanyl-N1,N4-bis(3-carbamimidoylphenyl)benzene-1,4-dicarboxamide chloride

Systemtic Name: 2-azanyl-N1,N4-bis(3-carbamimidoylphenyl)benzene-1,4-dicarboxamide chloride Openeye Name: 2-amino-N1,N4-bis(3-carbamimidoylphenyl)terephthalamide chloride CAS Name: 2-amino-N1,N4-bis(3-carbamimidoylphenyl)benzene-1,4-dicarboxamide chloride IUPAC Name: 2-amino-1-N,4-N-bis(3-carbamimidoylphenyl)benzene-1,4-dicarboxamide chloride Traditional Name: N,N'-bis(3-amidinophenyl)-2-amino-terephthalamide chloride Formula: C22H21ClN7O2- MolecularWeight: 450.90084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=CC(=C(C=C2)C(=O)NC3=CC=CC(=C3)C(=N)N)N)C(=N)N.[Cl-]

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=CC(=C(C=C2)C(=O)NC3=CC=CC(=C3)C(=N)N)N)C(=N)N.[Cl-]

InChI

InChI=1S/C22H21N7O2.ClH/c23-18-11-14(21(30)28-15-5-1-3-12(9-15)19(24)25)7-8-17(18)22(31)29-16-6-2-4-13(10-16)20(26)27;/h1-11H,23H2,(H3,24,25)(H3,26,27)(H,28,30)(H,29,31);1H/p-1