(5-ethoxy-1,3-dihydrobenzimidazol-2-ylidene)-[(2S)-2-oxidanylpropyl]azanium

Systemtic Name: (5-ethoxy-1,3-dihydrobenzimidazol-2-ylidene)-[(2S)-2-oxidanylpropyl]azanium Openeye Name: (5-ethoxy-1,3-dihydrobenzimidazol-2-ylidene)-[(2S)-2-hydroxypropyl]ammonium CAS Name: (5-ethoxy-1,3-dihydrobenzimidazol-2-ylidene)-[(2S)-2-hydroxypropyl]ammonium IUPAC Name: (5-ethoxy-1,3-dihydrobenzimidazol-2-ylidene)-[(2S)-2-hydroxypropyl]azanium Traditional Name: (5-ethoxy-1,3-dihydrobenzimidazol-2-ylidene)-[(2S)-2-hydroxypropyl]ammonium Formula: C12H18N3O2+ MolecularWeight: 236.29022

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC(=[NH+]CC(C)O)N2

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC(=[NH+]C[C@H](C)O)N2

InChI

InChI=1S/C12H17N3O2/c1-3-17-9-4-5-10-11(6-9)15-12(14-10)13-7-8(2)16/h4-6,8,16H,3,7H2,1-2H3,(H2,13,14,15)/p+1/t8-/m0/s1