2-(4-carbamimidoylphenyl)-1H-indole-6-carboximidamide hydrate dihydrochloride

Systemtic Name: 2-(4-carbamimidoylphenyl)-1H-indole-6-carboximidamide hydrate dihydrochloride Openeye Name: 2-(4-carbamimidoylphenyl)-1H-indole-6-carboxamidine hydrate dihydrochloride CAS Name: 2-(4-carbamimidoylphenyl)-1H-indole-6-carboximidamide hydrate dihydrochloride IUPAC Name: 2-(4-carbamimidoylphenyl)-1H-indole-6-carboximidamide hydrate dihydrochloride Traditional Name: 2-(4-amidinophenyl)-1H-indole-6-carboxamidine hydrate dihydrochloride Formula: C16H19Cl2N5O MolecularWeight: 368.26096

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC3=C(N2)C=C(C=C3)C(=N)N)C(=N)N.O.Cl.Cl

Isomeric SMILES

C1=CC(=CC=C1C2=CC3=C(N2)C=C(C=C3)C(=N)N)C(=N)N.O.Cl.Cl

InChI

InChI=1S/C16H15N5.2ClH.H2O/c17-15(18)10-3-1-9(2-4-10)13-7-11-5-6-12(16(19)20)8-14(11)21-13;;;/h1-8,21H,(H3,17,18)(H3,19,20);2*1H;1H2