| Properties | Image |
|---|
| MNX_ID | MNXM148092 |
 |
| reference | chebi:192681 |
| formula | C23H23N3O2 |
| global charge | 0 |
| mol weight | 373.456 |
| InChIKey | AVLMMDWEIUEKEK-AAIMPIBUSA-N |
| InChI | InChI=1S/C23H23N3O2/c1-4-22(2,3)23-13-18-19(27)24-16-11-7-5-9-14(16)20(28)26(18)21(23)25-17-12-8-6-10-15(17)23/h4-12,18,21,25H,1,13H2,2-3H3,(H,24,27)/t18-,21-,23+/m1/s1 |
| SMILES | C=CC(C)(C)[C@]12C[C@@H]3C([O-])=[NH+]C4=CC=CC=C4C(=O)N3[C@H]1NC1=CC=CC=C12 |
MNX internals
| InChI (mnx) | InChI=1/C23H23N3O2/c1-4-22(2,3)23-13-18-19(27)24-16-11-7-5-9-14(16)20(28)26(18)21(23)25-17-12-8-6-10-15(17)23/h4-12,18,21,25H,1,13H2,2-3H3,(H,24,27)/t18-,21-,23+/m1/s1 |
 |
| SMILES (mnx) | [CH2:1]=[CH:4][C:22]([CH3:2])([CH3:3])[C@:23]12[CH2:13][C@@H:18]3[C:19]([OH:27])=[N:24][C:16]4=[CH:11][CH:7]=[CH:5][CH:9]=[C:14]4[C:20](=[O:28])[N:26]3[C@H:21]1[NH:25][C:17]1=[CH:12][CH:8]=[CH:6][CH:10]=[C:15]12 |
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