| Stereochemistry | ABSOLUTE |
| Molecular Formula | C21H21N2O3.NO3 |
| Molecular Weight | 411.4079 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[O-][N+]([O-])=O.COC(=O)C1=CO[C@@H](C)[C@H]2C[N+]3=C(C[C@H]12)C4=C(C=C3)C5=C(N4)C=CC=C5
InChI
InChIKey=BIEFRVJCWZDXBE-RXAPEJBRSA-O
InChI=1S/C21H20N2O3.NO3/c1-12-16-10-23-8-7-14-13-5-3-4-6-18(13)22-20(14)19(23)9-15(16)17(11-26-12)21(24)25-2;2-1(3)4/h3-8,11-12,15-16H,9-10H2,1-2H3;/q;-1/p+1/t12-,15-,16+;/m0./s1
| Molecular Formula | C21H20N2O3 |
| Molecular Weight | 348.3951 |
| Charge | 0 |
| Count |
MOL RATIO
1 MOL RATIO (average) |
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | NO3 |
| Molecular Weight | 62.0049 |
| Charge | -1 |
| Count |
MOL RATIO
1 MOL RATIO (average) |
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
