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2-azanylethyl-[(2R)-2-azanyl-3-(1H-indol-1-ium-3-yl)propanoyl]azanium dichloride
2-azanylethyl-[(2R)-2-azanyl-3-(1H-indol-1-ium-3-yl)propanoyl]azanium dichloride
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Descriptors Computed from Structure
Canonical SMILES:
C1=CC=C2C(=C1)C(=C[NH2+]2)CC(C(=O)[NH2+]CCN)N.[Cl-].[Cl-]
Isomeric SMILES
C1=CC=C2C(=C1)C(=C[NH2+]2)C[C@H](C(=O)[NH2+]CCN)N.[Cl-].[Cl-]
InChI
InChI=1S/C13H18N4O.2ClH/c14-5-6-16-13(18)11(15)7-9-8-17-12-4-2-1-3-10(9)12;;/h1-4,8,11,17H,5-7,14-15H2,(H,16,18);2*1H/t11-;;/m1../s1
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