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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H22BrN3O3
Molecular Weight 396.279
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Ethyl (4aS,9bR)-6-bromo-1,3,4,4a,5,9b-hexahydro-5-[2-(methylamino)-2-oxoethyl]-2H-pyrido[4,3-b]indole-2-carboxylate

SMILES

[H][C@]12CCN(C[C@@]1([H])C3=CC=CC(Br)=C3N2CC(=O)NC)C(=O)OCC

InChI

InChIKey=KBVIWLNPPLXKFJ-JSGCOSHPSA-N
InChI=1S/C17H22BrN3O3/c1-3-24-17(23)20-8-7-14-12(9-20)11-5-4-6-13(18)16(11)21(14)10-15(22)19-2/h4-6,12,14H,3,7-10H2,1-2H3,(H,19,22)/t12-,14-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
Ethyl (4aS,9bR)-6-bromo-1,3,4,4a,5,9b-hexahydro-5-[2-(methylamino)-2-oxoethyl]-2H-pyrido[4,3-b]indole-2-carboxylate
Systematic Name English
(4aS,9bR)-Ethyl 6-bromo-5-(2-(methylamino)-2-oxoethyl)-3,4,4a,5-tetrahydro-1H-pyrido[4,3-b]indole-2(9bH)-carboxylate
Systematic Name English
2H-Pyrido[4,3-b]indole-2-carboxylic acid, 6-bromo-1,3,4,4a,5,9b-hexahydro-5-[2-(methylamino)-2-oxoethyl]-, ethyl ester, (4aS,9bR)-
Systematic Name English
Code System Code Type Description
FDA UNII
HSN873FZA2
Created by admin on Sat Dec 16 20:17:55 GMT 2023 , Edited by admin on Sat Dec 16 20:17:55 GMT 2023
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CAS
2098497-32-4
Created by admin on Sat Dec 16 20:17:55 GMT 2023 , Edited by admin on Sat Dec 16 20:17:55 GMT 2023
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PUBCHEM
59317964
Created by admin on Sat Dec 16 20:17:55 GMT 2023 , Edited by admin on Sat Dec 16 20:17:55 GMT 2023
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