| Properties | Image |
MNX_ID | MNXM529104 |
 |
reference | chebi:107974 |
formula | C25H29N3O2 |
global charge | 0 |
mol weight | 403.526 |
InChIKey | WVJPABJAYYPHQO-UHFFFAOYSA-N |
InChI | InChI=1S/C25H29N3O2/c1-14-10-19-20(11-15(14)2)28-24(17-6-8-18(9-7-17)26-16(3)29)23-21(27-19)12-25(4,5)13-22(23)30/h6-11,23-24,28H,12-13H2,1-5H3,(H,26,29) |
SMILES | CC(=O)NC1=CC=C(C2NC3=C(C=C(C)C(C)=C3)N=C3CC(C)(C)CC(=O)C32)C=C1 |
MNX internals
InChI (mnx) | InChI=1/C25H29N3O2/c1-14-10-19-20(11-15(14)2)28-24(17-6-8-18(9-7-17)26-16(3)29)23-21(27-19)12-25(4,5)13-22(23)30/h6-11,23-24,28H,12-13H2,1-5H3,(H,26,29)/t23?,24? |
 |
SMILES (mnx) | [CH3:1][C:14]1=[CH:10][C:19]2=[C:20]([CH:11]=[C:15]1[CH3:2])[NH:28][CH:24]([C:17]1=[CH:7][CH:9]=[C:18]([N:26]=[C:16]([CH3:3])[OH:29])[CH:8]=[CH:6]1)[CH:23]1[C:21](=[N:27]2)[CH2:12][C:25]([CH3:4])([CH3:5])[CH2:13][C:22]1=[O:30] |
|