[1-(2-morpholin-4-ylethyl)benzimidazol-2-yl]-[(3-nitrophenyl)methylidene]azanium

Systemtic Name: [1-(2-morpholin-4-ylethyl)benzimidazol-2-yl]-[(3-nitrophenyl)methylidene]azanium Openeye Name: [1-(2-morpholinoethyl)benzimidazol-2-yl]-[(3-nitrophenyl)methylene]ammonium CAS Name: [1-[2-(4-morpholinyl)ethyl]-2-benzimidazolyl]-[(3-nitrophenyl)methylidene]ammonium IUPAC Name: [1-(2-morpholin-4-ylethyl)benzimidazol-2-yl]-[(3-nitrophenyl)methylidene]azanium Traditional Name: [1-(2-morpholinoethyl)benzimidazol-2-yl]-(3-nitrobenzylidene)ammonium Formula: C20H22N5O3+ MolecularWeight: 380.42038

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCN2C3=CC=CC=C3N=C2[NH+]=CC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1CCN2C3=CC=CC=C3N=C2[NH+]=CC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O3/c26-25(27)17-5-3-4-16(14-17)15-21-20-22-18-6-1-2-7-19(18)24(20)9-8-23-10-12-28-13-11-23/h1-7,14-15H,8-13H2/p+1