cyclohexyl-[[3-(2-methoxy-2-oxidanylidene-ethyl)-4,8-dimethyl-7-oxidanyl-2-oxidanylidene-chromen-6-yl]methyl]azanium

Systemtic Name: cyclohexyl-[[3-(2-methoxy-2-oxidanylidene-ethyl)-4,8-dimethyl-7-oxidanyl-2-oxidanylidene-chromen-6-yl]methyl]azanium Openeye Name: cyclohexyl-[[7-hydroxy-3-(2-methoxy-2-oxo-ethyl)-4,8-dimethyl-2-oxo-chromen-6-yl]methyl]ammonium CAS Name: cyclohexyl-[[7-hydroxy-3-(2-methoxy-2-oxoethyl)-4,8-dimethyl-2-oxo-1-benzopyran-6-yl]methyl]ammonium IUPAC Name: cyclohexyl-[[7-hydroxy-3-(2-methoxy-2-oxoethyl)-4,8-dimethyl-2-oxochromen-6-yl]methyl]azanium Traditional Name: cyclohexyl-[[7-hydroxy-2-keto-3-(2-keto-2-methoxy-ethyl)-4,8-dimethyl-chromen-6-yl]methyl]ammonium Formula: C21H28NO5+ MolecularWeight: 374.45072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C(C(=C(C=C12)C[NH2+]C3CCCCC3)O)C)CC(=O)OC

Isomeric SMILES

CC1=C(C(=O)OC2=C(C(=C(C=C12)C[NH2+]C3CCCCC3)O)C)CC(=O)OC

InChI

InChI=1S/C21H27NO5/c1-12-16-9-14(11-22-15-7-5-4-6-8-15)19(24)13(2)20(16)27-21(25)17(12)10-18(23)26-3/h9,15,22,24H,4-8,10-11H2,1-3H3/p+1