2-(benzotriazol-1-yl)-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]ethanamide

Systemtic Name: 2-(benzotriazol-1-yl)-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]ethanamide Openeye Name: 2-(benzotriazol-1-yl)-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]acetamide CAS Name: 2-(1-benzotriazolyl)-N-[[2-(4-morpholin-4-iumylmethyl)phenyl]methyl]acetamide IUPAC Name: 2-(benzotriazol-1-yl)-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]acetamide Traditional Name: 2-(benzotriazol-1-yl)-N-[2-(morpholin-4-ium-4-ylmethyl)benzyl]acetamide Formula: C20H24N5O2+ MolecularWeight: 366.43686

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC=CC=C2CNC(=O)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

C1COCC[NH+]1CC2=CC=CC=C2CNC(=O)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C20H23N5O2/c26-20(15-25-19-8-4-3-7-18(19)22-23-25)21-13-16-5-1-2-6-17(16)14-24-9-11-27-12-10-24/h1-8H,9-15H2,(H,21,26)/p+1