1-ethyl-2-[(S)-furan-2-yl(piperazin-4-ium-1-yl)methyl]benzimidazole

Systemtic Name: 1-ethyl-2-[(S)-furan-2-yl(piperazin-4-ium-1-yl)methyl]benzimidazole Openeye Name: 1-ethyl-2-[(S)-2-furyl(piperazin-4-ium-1-yl)methyl]benzimidazole CAS Name: 1-ethyl-2-[(S)-2-furanyl(1-piperazin-4-iumyl)methyl]benzimidazole IUPAC Name: 1-ethyl-2-[(S)-furan-2-yl(piperazin-4-ium-1-yl)methyl]benzimidazole Traditional Name: 1-ethyl-2-[(S)-2-furyl(piperazin-4-ium-1-yl)methyl]benzimidazole Formula: C18H23N4O+ MolecularWeight: 311.40142

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1C(C3=CC=CO3)N4CC[NH2+]CC4

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1[C@@H](C3=CC=CO3)N4CC[NH2+]CC4

InChI

InChI=1S/C18H22N4O/c1-2-22-15-7-4-3-6-14(15)20-18(22)17(16-8-5-13-23-16)21-11-9-19-10-12-21/h3-8,13,17,19H,2,9-12H2,1H3/p+1/t17-/m1/s1