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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H33NO3
Molecular Weight 359.5023
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CYCLOMETHYCAINE, (R)-

SMILES

C[C@@H]1CCCCN1CCCOC(=O)C2=CC=C(OC3CCCCC3)C=C2

InChI

InChIKey=YLRNESBGEGGQBK-GOSISDBHSA-N
InChI=1S/C22H33NO3/c1-18-8-5-6-15-23(18)16-7-17-25-22(24)19-11-13-21(14-12-19)26-20-9-3-2-4-10-20/h11-14,18,20H,2-10,15-17H2,1H3/t18-/m1/s1

HIDE SMILES / InChI

Molecular Formula C22H33NO3
Molecular Weight 359.5023
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
9BES19965K
Record Status Validated (UNII)
Record Version