[(3S,4R)-7-methyl-4-oxidanyl-spiro[3,4-dihydrochromene-2,1'-cyclohexane]-3-yl]azanium

Systemtic Name: [(3S,4R)-7-methyl-4-oxidanyl-spiro[3,4-dihydrochromene-2,1'-cyclohexane]-3-yl]azanium Openeye Name: [(3S,4R)-4-hydroxy-7-methyl-spiro[chromane-2,1'-cyclohexane]-3-yl]ammonium CAS Name: [(3S,4R)-4-hydroxy-7-methyl-3-spiro[3,4-dihydro-2H-1-benzopyran-2,1'-cyclohexane]yl]ammonium IUPAC Name: [(3S,4R)-4-hydroxy-7-methylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-3-yl]azanium Traditional Name: [(3S,4R)-4-hydroxy-7-methyl-spiro[chroman-2,1'-cyclohexane]-3-yl]ammonium Formula: C15H22NO2+ MolecularWeight: 248.34068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(C(C3(O2)CCCCC3)[NH3+])O

Isomeric SMILES

CC1=CC2=C(C=C1)[C@H]([C@@H](C3(O2)CCCCC3)[NH3+])O

InChI

InChI=1S/C15H21NO2/c1-10-5-6-11-12(9-10)18-15(14(16)13(11)17)7-3-2-4-8-15/h5-6,9,13-14,17H,2-4,7-8,16H2,1H3/p+1/t13-,14+/m1/s1