Stereochemistry | ABSOLUTE |
Molecular Formula | C19H24NO3.I |
Molecular Weight | 441.3032 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 3 / 4 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[I-].COC1=CC=C2C[C@@H]3[C@@H]4C=CC(=O)C[C@]4(CC[N+]3(C)C)C2=C1O
InChI
InChIKey=MULUZLQJNWOMRS-JYRFYKTESA-N
InChI=1S/C19H23NO3.HI/c1-20(2)9-8-19-11-13(21)5-6-14(19)15(20)10-12-4-7-16(23-3)18(22)17(12)19;/h4-7,14-15H,8-11H2,1-3H3;1H/t14-,15+,19-;/m0./s1
Molecular Formula | HI |
Molecular Weight | 127.91241 |
Charge | 0 |
Count |
MOL RATIO
1 MOL RATIO (average) |
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C19H23NO3 |
Molecular Weight | 313.3908 |
Charge | 0 |
Count |
MOL RATIO
1 MOL RATIO (average) |
Stereochemistry | EPIMERIC |
Additional Stereochemistry | No |
Defined Stereocenters | 3 / 4 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |