(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl-(4-oxidanylcyclohexyl)azanium

Systemtic Name: (7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl-(4-oxidanylcyclohexyl)azanium Openeye Name: (4-hydroxycyclohexyl)-[(6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl]ammonium CAS Name: (4-hydroxycyclohexyl)-[(7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methyl]ammonium IUPAC Name: (4-hydroxycyclohexyl)-[(7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methyl]azanium Traditional Name: (4-hydroxycyclohexyl)-[(6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl]ammonium Formula: C20H28NO3+ MolecularWeight: 330.44122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)C[NH2+]C3CCC(CC3)O)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)C[NH2+]C3CCC(CC3)O)C(C)C

InChI

InChI=1S/C20H27NO3/c1-12(2)17-10-18-14(9-20(23)24-19(18)8-13(17)3)11-21-15-4-6-16(22)7-5-15/h8-10,12,15-16,21-22H,4-7,11H2,1-3H3/p+1