| Properties | Image |
MNX_ID | MNXM167574 |
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reference | sabiorkM:28108 |
formula | C9H12N2O |
global charge | 0 |
mol weight | 164.208 |
InChIKey | OBSIQMZKFXFYLV-MRVPVSSYSA-N |
InChI | InChI=1S/C9H12N2O/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H2,11,12)/t8-/m1/s1 |
SMILES | N=C(O)[C@H](N)CC1=CC=CC=C1 |
MNX internals
InChI (mnx) | InChI=1/C9H12N2O/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H2,11,12)/t8-/m1/s1 |
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SMILES (mnx) | [CH:1]1=[CH:2][CH:4]=[C:7]([CH2:6][C@H:8]([C:9](=[NH:11])[OH:12])[NH2:10])[CH:5]=[CH:3]1 |
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