N-[1-(2-morpholin-4-ium-4-ylethyl)benzimidazol-2-yl]-1-(3-nitrophenyl)methanimine

Systemtic Name: N-[1-(2-morpholin-4-ium-4-ylethyl)benzimidazol-2-yl]-1-(3-nitrophenyl)methanimine Openeye Name: N-[1-(2-morpholin-4-ium-4-ylethyl)benzimidazol-2-yl]-1-(3-nitrophenyl)methanimine CAS Name: N-[1-[2-(4-morpholin-4-iumyl)ethyl]-2-benzimidazolyl]-1-(3-nitrophenyl)methanimine IUPAC Name: N-[1-(2-morpholin-4-ium-4-ylethyl)benzimidazol-2-yl]-1-(3-nitrophenyl)methanimine Traditional Name: [1-(2-morpholin-4-ium-4-ylethyl)benzimidazol-2-yl]-(3-nitrobenzylidene)amine Formula: C20H22N5O3+ MolecularWeight: 380.42038

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCN2C3=CC=CC=C3N=C2N=CC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CCN2C3=CC=CC=C3N=C2N=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