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methyl (2S)-2-(1-adamantyl)-2-benzamido-ethanoate

methyl (2S)-2-(1-adamantyl)-2-benzamido-ethanoate

Systemtic Name:methyl (2S)-2-(1-adamantyl)-2-benzamido-ethanoate
Openeye Name:methyl (2S)-2-(1-adamantyl)-2-benzamido-acetate
CAS Name:(2S)-2-(1-adamantyl)-2-benzamidoacetic acid methyl ester
IUPAC Name:methyl (2S)-2-(1-adamantyl)-2-benzamidoacetate
Traditional Name:(2S)-2-(1-adamantyl)-2-benzamido-acetic acid methyl ester
Formula: C20H25NO3
MolecularWeight: 327.4174
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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=CC=CC=C4


Isomeric SMILES

COC(=O)[C@H](C12CC3CC(C1)CC(C3)C2)NC(=O)C4=CC=CC=C4


InChI

InChI=1S/C20H25NO3/c1-24-19(23)17(21-18(22)16-5-3-2-4-6-16)20-10-13-7-14(11-20)9-15(8-13)12-20/h2-6,13-15,17H,7-12H2,1H3,(H,21,22)/t13?,14?,15?,17-,20?/m1/s1


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