(6-ethyl-4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methyl-methyl-[(4-morpholin-4-ylphenyl)methyl]azanium

Systemtic Name: (6-ethyl-4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methyl-methyl-[(4-morpholin-4-ylphenyl)methyl]azanium Openeye Name: (6-ethyl-7-hydroxy-4-methyl-2-oxo-chromen-8-yl)methyl-methyl-[(4-morpholinophenyl)methyl]ammonium CAS Name: (6-ethyl-7-hydroxy-4-methyl-2-oxo-1-benzopyran-8-yl)methyl-methyl-[[4-(4-morpholinyl)phenyl]methyl]ammonium IUPAC Name: (6-ethyl-7-hydroxy-4-methyl-2-oxochromen-8-yl)methyl-methyl-[(4-morpholin-4-ylphenyl)methyl]azanium Traditional Name: (6-ethyl-7-hydroxy-2-keto-4-methyl-chromen-8-yl)methyl-methyl-(4-morpholinobenzyl)ammonium Formula: C25H31N2O4+ MolecularWeight: 423.52464

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2C(=C1)C(=CC(=O)O2)C)C[NH+](C)CC3=CC=C(C=C3)N4CCOCC4)O

Isomeric SMILES

CCC1=C(C(=C2C(=C1)C(=CC(=O)O2)C)C[NH+](C)CC3=CC=C(C=C3)N4CCOCC4)O

InChI

InChI=1S/C25H30N2O4/c1-4-19-14-21-17(2)13-23(28)31-25(21)22(24(19)29)16-26(3)15-18-5-7-20(8-6-18)27-9-11-30-12-10-27/h5-8,13-14,29H,4,9-12,15-16H2,1-3H3/p+1