2-[6-carbamimidoyl-2-(4-carbamimidoylphenyl)-1H-indol-3-yl]ethanoic acid dihydrochloride

Systemtic Name: 2-[6-carbamimidoyl-2-(4-carbamimidoylphenyl)-1H-indol-3-yl]ethanoic acid dihydrochloride Openeye Name: 2-[6-carbamimidoyl-2-(4-carbamimidoylphenyl)-1H-indol-3-yl]acetic acid dihydrochloride CAS Name: 2-[6-carbamimidoyl-2-(4-carbamimidoylphenyl)-1H-indol-3-yl]acetic acid dihydrochloride IUPAC Name: 2-[6-carbamimidoyl-2-(4-carbamimidoylphenyl)-1H-indol-3-yl]acetic acid dihydrochloride Traditional Name: 2-[6-amidino-2-(4-amidinophenyl)-1H-indol-3-yl]acetic acid dihydrochloride Formula: C18H19Cl2N5O2 MolecularWeight: 408.28176

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17N5O2.2ClH/c19-17(20)10-3-1-9(2-4-10)16-13(8-15(24)25)12-6-5-11(18(21)22)7-14(12)23-16;;/h1-7,23H,8H2,(H3,19,20)(H3,21,22)(H,24,25);2*1H