1-[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]-N-(1,2,4-triazol-4-yl)methanimine

Systemtic Name: 1-[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]-N-(1,2,4-triazol-4-yl)methanimine Openeye Name: 1-[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]-N-(1,2,4-triazol-4-yl)methanimine CAS Name: 1-[4-methoxy-3-(4-morpholin-4-iumylmethyl)phenyl]-N-(1,2,4-triazol-4-yl)methanimine IUPAC Name: 1-[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]-N-(1,2,4-triazol-4-yl)methanimine Traditional Name: (Z)-[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)benzylidene]-(1,2,4-triazol-4-yl)amine Formula: C15H20N5O2+ MolecularWeight: 302.3516

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NN2C=NN=C2)C[NH+]3CCOCC3

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N\N2C=NN=C2)C[NH+]3CCOCC3

InChI

InChI=1S/C15H19N5O2/c1-21-15-3-2-13(9-18-20-11-16-17-12-20)8-14(15)10-19-4-6-22-7-5-19/h2-3,8-9,11-12H,4-7,10H2,1H3/p+1/b18-9-