N-(3-azanyl-3-azanylidene-propyl)-4-[[(4-carbamimidoylphenyl)amino]diazenyl]benzamide dihydrochloride

Systemtic Name: N-(3-azanyl-3-azanylidene-propyl)-4-[[(4-carbamimidoylphenyl)amino]diazenyl]benzamide dihydrochloride Openeye Name: N-(3-amino-3-imino-propyl)-4-(4-carbamimidoylanilino)azo-benzamide dihydrochloride CAS Name: N-(3-amino-3-iminopropyl)-4-(4-carbamimidoylanilino)azobenzamide dihydrochloride IUPAC Name: N-(3-amino-3-iminopropyl)-4-[(4-carbamimidoylanilino)diazenyl]benzamide dihydrochloride Traditional Name: 4-(4-amidinoanilino)azo-N-(3-amino-3-imino-propyl)benzamide dihydrochloride Formula: C17H22Cl2N8O MolecularWeight: 425.31558

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=N)N)NN=NC2=CC=C(C=C2)C(=O)NCCC(=N)N.Cl.Cl

Isomeric SMILES

C1=CC(=CC=C1C(=N)N)NN=NC2=CC=C(C=C2)C(=O)NCCC(=N)N.Cl.Cl

InChI

InChI=1S/C17H20N8O.2ClH/c18-15(19)9-10-22-17(26)12-3-7-14(8-4-12)24-25-23-13-5-1-11(2-6-13)16(20)21;;/h1-8H,9-10H2,(H3,18,19)(H3,20,21)(H,22,26)(H,23,24);2*1H