N1-[2-[[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-2-oxidanylidene-ethyl]-N4,N4-dioctadecyl-benzene-1,4-dicarboxamide

Systemtic Name: N1-[2-[[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-2-oxidanylidene-ethyl]-N4,N4-dioctadecyl-benzene-1,4-dicarboxamide Openeye Name: N1-[2-[[(1S)-2-amino-1-benzyl-2-oxo-ethyl]amino]-2-oxo-ethyl]-N4,N4-dioctadecyl-terephthalamide CAS Name: N1-[2-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]-N4,N4-dioctadecylbenzene-1,4-dicarboxamide IUPAC Name: 1-N-[2-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]-4-N,4-N-dioctadecylbenzene-1,4-dicarboxamide Traditional Name: N-[2-[[(1S)-2-amino-1-benzyl-2-keto-ethyl]amino]-2-keto-ethyl]-N',N'-distearyl-terephthalamide Formula: C55H92N4O4 MolecularWeight: 873.34338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCCCC)C(=O)C1=CC=C(C=C1)C(=O)NCC(=O)NC(CC2=CC=CC=C2)C(=O)N

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCCCC)C(=O)C1=CC=C(C=C1)C(=O)NCC(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N

InChI

InChI=1S/C55H92N4O4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-36-44-59(45-37-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)55(63)50-42-40-49(41-43-50)54(62)57-47-52(60)58-51(53(56)61)46-48-38-34-33-35-39-48/h33-35,38-43,51H,3-32,36-37,44-47H2,1-2H3,(H2,56,61)(H,57,62)(H,58,60)/t51-/m0/s1