2-methyl-6-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]iminomethyl]-4-nitro-phenolate

Systemtic Name: 2-methyl-6-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]iminomethyl]-4-nitro-phenolate Openeye Name: 2-methyl-6-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]iminomethyl]-4-nitro-phenolate CAS Name: 2-methyl-6-[[4-(4-morpholin-4-iumylmethyl)phenyl]iminomethyl]-4-nitrophenolate IUPAC Name: 2-methyl-6-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]iminomethyl]-4-nitrophenolate Traditional Name: 2-methyl-6-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]iminomethyl]-4-nitro-phenolate Formula: C19H21N3O4 MolecularWeight: 355.38774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)[N+](=O)[O-])C=NC2=CC=C(C=C2)C[NH+]3CCOCC3)[O-]

Isomeric SMILES

CC1=C(C(=CC(=C1)[N+](=O)[O-])C=NC2=CC=C(C=C2)C[NH+]3CCOCC3)[O-]

InChI

InChI=1S/C19H21N3O4/c1-14-10-18(22(24)25)11-16(19(14)23)12-20-17-4-2-15(3-5-17)13-21-6-8-26-9-7-21/h2-5,10-12,23H,6-9,13H2,1H3