2-[2-azanylidene-3-[(2S)-2-(furan-2-yl)-2-oxidanyl-ethyl]benzimidazol-1-yl]ethyl-diethyl-azanium

Systemtic Name: 2-[2-azanylidene-3-[(2S)-2-(furan-2-yl)-2-oxidanyl-ethyl]benzimidazol-1-yl]ethyl-diethyl-azanium Openeye Name: diethyl-[2-[3-[(2S)-2-(2-furyl)-2-hydroxy-ethyl]-2-imino-benzimidazol-1-yl]ethyl]ammonium CAS Name: diethyl-[2-[3-[(2S)-2-(2-furanyl)-2-hydroxyethyl]-2-imino-1-benzimidazolyl]ethyl]ammonium IUPAC Name: diethyl-[2-[3-[(2S)-2-(furan-2-yl)-2-hydroxyethyl]-2-iminobenzimidazol-1-yl]ethyl]azanium Traditional Name: diethyl-[2-[3-[(2S)-2-(2-furyl)-2-hydroxy-ethyl]-2-imino-benzimidazol-1-yl]ethyl]ammonium Formula: C19H27N4O2+ MolecularWeight: 343.44328

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN1C2=CC=CC=C2N(C1=N)CC(C3=CC=CO3)O

Isomeric SMILES

CC[NH+](CC)CCN1C2=CC=CC=C2N(C1=N)C[C@@H](C3=CC=CO3)O

InChI

InChI=1S/C19H26N4O2/c1-3-21(4-2)11-12-22-15-8-5-6-9-16(15)23(19(22)20)14-17(24)18-10-7-13-25-18/h5-10,13,17,20,24H,3-4,11-12,14H2,1-2H3/p+1/t17-/m0/s1