2-[2-[2-[3-(dimethylamino)propylcarbamoyl]piperidin-1-yl]ethyl]octadecanoate

Systemtic Name: 2-[2-[2-[3-(dimethylamino)propylcarbamoyl]piperidin-1-yl]ethyl]octadecanoate Openeye Name: 2-[2-[2-[3-(dimethylamino)propylcarbamoyl]-1-piperidyl]ethyl]octadecanoate CAS Name: 2-[2-[2-[[3-(dimethylamino)propylamino]-oxomethyl]-1-piperidinyl]ethyl]octadecanoate IUPAC Name: 2-[2-[2-[3-(dimethylamino)propylcarbamoyl]piperidin-1-yl]ethyl]octadecanoate Traditional Name: 2-[2-[2-[3-(dimethylamino)propylcarbamoyl]piperidino]ethyl]stearate Formula: C31H60N3O3- MolecularWeight: 522.8264

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(CCN1CCCCC1C(=O)NCCCN(C)C)C(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCC(CCN1CCCCC1C(=O)NCCCN(C)C)C(=O)[O-]

InChI

InChI=1S/C31H61N3O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-28(31(36)37)23-27-34-26-19-18-22-29(34)30(35)32-24-20-25-33(2)3/h28-29H,4-27H2,1-3H3,(H,32,35)(H,36,37)/p-1