(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-(2-methyl-2-morpholin-4-ium-4-yl-propyl)azanium

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-(2-methyl-2-morpholin-4-ium-4-yl-propyl)azanium Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl-(2-methyl-2-morpholin-4-ium-4-yl-propyl)ammonium CAS Name: (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl-[2-methyl-2-(4-morpholin-4-iumyl)propyl]ammonium IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl-(2-methyl-2-morpholin-4-ium-4-ylpropyl)azanium Traditional Name: (2-keto-6,7-dimethyl-chromen-4-yl)methyl-(2-methyl-2-morpholin-4-ium-4-yl-propyl)ammonium Formula: C20H30N2O3+2 MolecularWeight: 346.4638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH2+]CC(C)(C)[NH+]3CCOCC3)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH2+]CC(C)(C)[NH+]3CCOCC3)C

InChI

InChI=1S/C20H28N2O3/c1-14-9-17-16(11-19(23)25-18(17)10-15(14)2)12-21-13-20(3,4)22-5-7-24-8-6-22/h9-11,21H,5-8,12-13H2,1-4H3/p+2