cocaethylene

Chemical Formula:

C₁₈H₂₄NO₄

Molecular Weight:

318.392 Daltons

Monoisotopic Mass:

318.170533264 Daltons

SMILES:

CCOC(=O)C2([CH]3([N+](C)[CH](CC(OC(C1(C=CC=CC=1))=O)2)CC3))

InChI:

1S/C18H23NO4/c1-3-22-18(21)16-14-10-9-13(19(14)2)11-15(16)23-17(20)12-7-5-4-6-8-12/h4-8,13-16H,3,9-11H2,1-2H3/p+1/t13-,14+,15-,16+/m0/s1

InChIKey:

NMPOSNRHZIWLLL-XUWVNRHRSA-O

Synonyms

Databases

MetaCyc: CPD-14390

PubChem (CID): 40479688

Wikipedia: Cocaethylene

Seed: cpd24339

HMDB: HMDB41860

MetaNetX: MNXM16810