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Details

Stereochemistry RACEMIC
Molecular Formula C11H13NO3.C10H17N
Molecular Weight 358.4745
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AMANTADINE AFALANINE

SMILES

NC12CC3CC(CC(C3)C1)C2.CC(=O)NC(CC4=CC=CC=C4)C(O)=O

InChI

InChIKey=NVJQQPSVBSYLGM-UHFFFAOYSA-N
InChI=1S/C11H13NO3.C10H17N/c1-8(13)12-10(11(14)15)7-9-5-3-2-4-6-9;11-10-4-7-1-8(5-10)3-9(2-7)6-10/h2-6,10H,7H2,1H3,(H,12,13)(H,14,15);7-9H,1-6,11H2

HIDE SMILES / InChI

Molecular Formula C10H17N
Molecular Weight 151.2487
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 C11H13NO3
Molecular Weight 207.2258
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Record UNII
089A9I6QBP
Record Status Validated (UNII)
Record Version