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1-adamantylmethyl-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl]azanium

1-adamantylmethyl-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl]azanium

Systemtic Name:1-adamantylmethyl-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl]azanium
Openeye Name:1-adamantylmethyl-[(7-methoxy-2-oxo-chromen-4-yl)methyl]ammonium
CAS Name:1-adamantylmethyl-[(7-methoxy-2-oxo-1-benzopyran-4-yl)methyl]ammonium
IUPAC Name:1-adamantylmethyl-[(7-methoxy-2-oxochromen-4-yl)methyl]azanium
Traditional Name:1-adamantylmethyl-[(2-keto-7-methoxy-chromen-4-yl)methyl]ammonium
Formula: C22H28NO3+
MolecularWeight: 354.46262
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH2+]CC34CC5CC(C3)CC(C5)C4


Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH2+]CC34CC5CC(C3)CC(C5)C4


InChI

InChI=1S/C22H27NO3/c1-25-18-2-3-19-17(7-21(24)26-20(19)8-18)12-23-13-22-9-14-4-15(10-22)6-16(5-14)11-22/h2-3,7-8,14-16,23H,4-6,9-13H2,1H3/p+1


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