(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl-[(2S)-pentan-2-yl]azanium

Systemtic Name: (8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl-[(2S)-pentan-2-yl]azanium Openeye Name: (7-hydroxy-8-methyl-2-oxo-chromen-4-yl)methyl-[(1S)-1-methylbutyl]ammonium CAS Name: (7-hydroxy-8-methyl-2-oxo-1-benzopyran-4-yl)methyl-[(2S)-pentan-2-yl]ammonium IUPAC Name: (7-hydroxy-8-methyl-2-oxochromen-4-yl)methyl-[(2S)-pentan-2-yl]azanium Traditional Name: (7-hydroxy-2-keto-8-methyl-chromen-4-yl)methyl-[(1S)-1-methylbutyl]ammonium Formula: C16H22NO3+ MolecularWeight: 276.35078

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)[NH2+]CC1=CC(=O)OC2=C1C=CC(=C2C)O

Isomeric SMILES

CCC[C@H](C)[NH2+]CC1=CC(=O)OC2=C1C=CC(=C2C)O

InChI

InChI=1S/C16H21NO3/c1-4-5-10(2)17-9-12-8-15(19)20-16-11(3)14(18)7-6-13(12)16/h6-8,10,17-18H,4-5,9H2,1-3H3/p+1/t10-/m0/s1