(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl-[(1S,2S)-2-methylcyclohexyl]azanium

Systemtic Name: (7-methoxy-2-oxidanylidene-chromen-4-yl)methyl-[(1S,2S)-2-methylcyclohexyl]azanium Openeye Name: (7-methoxy-2-oxo-chromen-4-yl)methyl-[(1S,2S)-2-methylcyclohexyl]ammonium CAS Name: (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl-[(1S,2S)-2-methylcyclohexyl]ammonium IUPAC Name: (7-methoxy-2-oxochromen-4-yl)methyl-[(1S,2S)-2-methylcyclohexyl]azanium Traditional Name: (2-keto-7-methoxy-chromen-4-yl)methyl-[(1S,2S)-2-methylcyclohexyl]ammonium Formula: C18H24NO3+ MolecularWeight: 302.38806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1[NH2+]CC2=CC(=O)OC3=C2C=CC(=C3)OC

Isomeric SMILES

C[C@H]1CCCC[C@@H]1[NH2+]CC2=CC(=O)OC3=C2C=CC(=C3)OC

InChI

InChI=1S/C18H23NO3/c1-12-5-3-4-6-16(12)19-11-13-9-18(20)22-17-10-14(21-2)7-8-15(13)17/h7-10,12,16,19H,3-6,11H2,1-2H3/p+1/t12-,16-/m0/s1