2-[N-[3-(diethylazaniumyl)propyl]-C-methyl-carbonimidoyl]-3-oxidanylidene-inden-1-olate

Systemtic Name: 2-[N-[3-(diethylazaniumyl)propyl]-C-methyl-carbonimidoyl]-3-oxidanylidene-inden-1-olate Openeye Name: 2-[N-[3-(diethylammonio)propyl]-C-methyl-carbonimidoyl]-3-oxo-inden-1-olate CAS Name: 2-[1-[3-(diethylammonio)propylimino]ethyl]-3-oxo-1-indenolate IUPAC Name: 2-[N-[3-(diethylazaniumyl)propyl]-C-methylcarbonimidoyl]-3-oxoinden-1-olate Traditional Name: 2-[N-[3-(diethylammonio)propyl]-C-methyl-carbonimidoyl]-3-keto-inden-1-olate Formula: C18H24N2O2 MolecularWeight: 300.39536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCN=C(C)C1=C(C2=CC=CC=C2C1=O)[O-]

Isomeric SMILES

CC[NH+](CC)CCCN=C(C)C1=C(C2=CC=CC=C2C1=O)[O-]

InChI

InChI=1S/C18H24N2O2/c1-4-20(5-2)12-8-11-19-13(3)16-17(21)14-9-6-7-10-15(14)18(16)22/h6-7,9-10,21H,4-5,8,11-12H2,1-3H3