2-[(2-methyl-2-morpholin-4-ium-4-yl-propyl)iminomethyl]-4-nitro-phenolate

Systemtic Name: 2-[(2-methyl-2-morpholin-4-ium-4-yl-propyl)iminomethyl]-4-nitro-phenolate Openeye Name: 2-[(2-methyl-2-morpholin-4-ium-4-yl-propyl)iminomethyl]-4-nitro-phenolate CAS Name: 2-[[2-methyl-2-(4-morpholin-4-iumyl)propyl]iminomethyl]-4-nitrophenolate IUPAC Name: 2-[(2-methyl-2-morpholin-4-ium-4-ylpropyl)iminomethyl]-4-nitrophenolate Traditional Name: 2-[(2-methyl-2-morpholin-4-ium-4-yl-propyl)iminomethyl]-4-nitro-phenolate Formula: C15H21N3O4 MolecularWeight: 307.34494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN=CC1=C(C=CC(=C1)[N+](=O)[O-])[O-])[NH+]2CCOCC2

Isomeric SMILES

CC(C)(CN=CC1=C(C=CC(=C1)[N+](=O)[O-])[O-])[NH+]2CCOCC2

InChI

InChI=1S/C15H21N3O4/c1-15(2,17-5-7-22-8-6-17)11-16-10-12-9-13(18(20)21)3-4-14(12)19/h3-4,9-10,19H,5-8,11H2,1-2H3