2-[C-methyl-N-(3-morpholin-4-ium-4-ylpropyl)carbonimidoyl]indene-1,3-dione

Systemtic Name: 2-[C-methyl-N-(3-morpholin-4-ium-4-ylpropyl)carbonimidoyl]indene-1,3-dione Openeye Name: 2-[C-methyl-N-(3-morpholin-4-ium-4-ylpropyl)carbonimidoyl]indane-1,3-dione CAS Name: 2-[1-[3-(4-morpholin-4-iumyl)propylimino]ethyl]indene-1,3-dione IUPAC Name: 2-[C-methyl-N-(3-morpholin-4-ium-4-ylpropyl)carbonimidoyl]indene-1,3-dione Traditional Name: 2-[C-methyl-N-(3-morpholin-4-ium-4-ylpropyl)carbonimidoyl]indane-1,3-quinone Formula: C18H23N2O3+ MolecularWeight: 315.38682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NCCC[NH+]1CCOCC1)C2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(=NCCC[NH+]1CCOCC1)C2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C18H22N2O3/c1-13(19-7-4-8-20-9-11-23-12-10-20)16-17(21)14-5-2-3-6-15(14)18(16)22/h2-3,5-6,16H,4,7-12H2,1H3/p+1