[(2R)-2-azanyl-3-(1H-indol-1-ium-3-yl)propanoyl]-(2-pyrrolidin-1-ylethyl)azanium dichloride

Systemtic Name: [(2R)-2-azanyl-3-(1H-indol-1-ium-3-yl)propanoyl]-(2-pyrrolidin-1-ylethyl)azanium dichloride Openeye Name: [(2R)-2-amino-3-(1H-indol-1-ium-3-yl)propanoyl]-(2-pyrrolidin-1-ylethyl)ammonium dichloride CAS Name: [(2R)-2-amino-3-(1H-indol-1-ium-3-yl)-1-oxopropyl]-[2-(1-pyrrolidinyl)ethyl]ammonium dichloride IUPAC Name: [(2R)-2-amino-3-(1H-indol-1-ium-3-yl)propanoyl]-(2-pyrrolidin-1-ylethyl)azanium dichloride Traditional Name: [(2R)-2-amino-3-(1H-indol-1-ium-3-yl)propanoyl]-(2-pyrrolidinoethyl)ammonium dichloride Formula: C17H26Cl2N4O MolecularWeight: 373.32054

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC[NH2+]C(=O)C(CC2=C[NH2+]C3=CC=CC=C32)N.[Cl-].[Cl-]

Isomeric SMILES

C1CCN(C1)CC[NH2+]C(=O)[C@@H](CC2=C[NH2+]C3=CC=CC=C32)N.[Cl-].[Cl-]

InChI

InChI=1S/C17H24N4O.2ClH/c18-15(17(22)19-7-10-21-8-3-4-9-21)11-13-12-20-16-6-2-1-5-14(13)16;;/h1-2,5-6,12,15,20H,3-4,7-11,18H2,(H,19,22);2*1H/t15-;;/m1../s1