(4-phenylphenyl)methyl 2-[2-(1-adamantyl)ethanoylamino]ethanoate

Systemtic Name: (4-phenylphenyl)methyl 2-[2-(1-adamantyl)ethanoylamino]ethanoate Openeye Name: (4-phenylphenyl)methyl 2-[[2-(1-adamantyl)acetyl]amino]acetate CAS Name: 2-[[2-(1-adamantyl)-1-oxoethyl]amino]acetic acid (4-phenylphenyl)methyl ester IUPAC Name: (4-phenylphenyl)methyl 2-[[2-(1-adamantyl)acetyl]amino]acetate Traditional Name: 2-[[2-(1-adamantyl)acetyl]amino]acetic acid (4-phenylbenzyl) ester Formula: C27H31NO3 MolecularWeight: 417.53994

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CC(=O)NCC(=O)OCC4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CC(=O)NCC(=O)OCC4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H31NO3/c29-25(16-27-13-20-10-21(14-27)12-22(11-20)15-27)28-17-26(30)31-18-19-6-8-24(9-7-19)23-4-2-1-3-5-23/h1-9,20-22H,10-18H2,(H,28,29)