O1-(16-oxidanylidenehexadecanoyl) O6-(phenylmethyl) 2-(piperidin-1-ylcarbonylamino)hexanedioate

Systemtic Name: O1-(16-oxidanylidenehexadecanoyl) O6-(phenylmethyl) 2-(piperidin-1-ylcarbonylamino)hexanedioate Openeye Name: O6-benzyl O1-(16-oxohexadecanoyl) 2-(piperidine-1-carbonylamino)hexanedioate CAS Name: 2-[[oxo(1-piperidinyl)methyl]amino]hexanedioic acid O1-(1,16-dioxohexadecyl) ester O6-(phenylmethyl) ester IUPAC Name: 6-O-benzyl 1-O-(16-oxohexadecanoyl) 2-(piperidine-1-carbonylamino)hexanedioate Traditional Name: 2-(piperidine-1-carbonylamino)adipic acid O6-benzyl ester O1-(16-ketohexadecanoyl) ester Formula: C35H54N2O7 MolecularWeight: 614.81246

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)NC(CCCC(=O)OCC2=CC=CC=C2)C(=O)OC(=O)CCCCCCCCCCCCCCC=O

Isomeric SMILES

C1CCN(CC1)C(=O)NC(CCCC(=O)OCC2=CC=CC=C2)C(=O)OC(=O)CCCCCCCCCCCCCCC=O

InChI

InChI=1S/C35H54N2O7/c38-28-19-11-9-7-5-3-1-2-4-6-8-10-16-24-33(40)44-34(41)31(36-35(42)37-26-17-13-18-27-37)23-20-25-32(39)43-29-30-21-14-12-15-22-30/h12,14-15,21-22,28,31H,1-11,13,16-20,23-27,29H2,(H,36,42)