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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H20ClNO2
Molecular Weight 317.81
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of α-Chlorocodide

SMILES

[H][C@@]12OC3=C(OC)C=CC4=C3[C@@]15CCN(C)[C@H](C4)[C@]5([H])C=C[C@H]2Cl

InChI

InChIKey=CVLHOXTTXWEUCL-KEMUOJQUSA-N
InChI=1S/C18H20ClNO2/c1-20-8-7-18-11-4-5-12(19)17(18)22-16-14(21-2)6-3-10(15(16)18)9-13(11)20/h3-6,11-13,17H,7-9H2,1-2H3/t11-,12+,13+,17-,18-/m0/s1

HIDE SMILES / InChI

Molecular Formula C18H20ClNO2
Molecular Weight 317.81
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
4YWU3WE48H
Record Status Validated (UNII)
Record Version