(2S)-N-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-2-morpholin-4-ium-4-yl-2-pyridin-4-yl-ethanamide

Systemtic Name: (2S)-N-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-2-morpholin-4-ium-4-yl-2-pyridin-4-yl-ethanamide Openeye Name: (2S)-N-[(Z)-1,3-benzodioxol-5-ylmethyleneamino]-2-morpholin-4-ium-4-yl-2-(4-pyridyl)acetamide CAS Name: (2S)-N-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-2-(4-morpholin-4-iumyl)-2-pyridin-4-ylacetamide IUPAC Name: (2S)-N-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-2-morpholin-4-ium-4-yl-2-pyridin-4-ylacetamide Traditional Name: (2S)-2-morpholin-4-ium-4-yl-N-[(Z)-piperonylideneamino]-2-(4-pyridyl)acetamide Formula: C19H21N4O4+ MolecularWeight: 369.39444

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1C(C2=CC=NC=C2)C(=O)NN=CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1COCC[NH+]1[C@@H](C2=CC=NC=C2)C(=O)N/N=C\C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H20N4O4/c24-19(22-21-12-14-1-2-16-17(11-14)27-13-26-16)18(15-3-5-20-6-4-15)23-7-9-25-10-8-23/h1-6,11-12,18H,7-10,13H2,(H,22,24)/p+1/b21-12-/t18-/m0/s1