methyl (2S)-2-(1-adamantylcarbonylamino)-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-(1-adamantylcarbonylamino)-3-phenyl-propanoate Openeye Name: methyl (2S)-2-(adamantane-1-carbonylamino)-3-phenyl-propanoate CAS Name: (2S)-2-[[1-adamantyl(oxo)methyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-(adamantane-1-carbonylamino)-3-phenylpropanoate Traditional Name: (2S)-2-(adamantane-1-carbonylamino)-3-phenyl-propionic acid methyl ester Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H27NO3/c1-25-19(23)18(10-14-5-3-2-4-6-14)22-20(24)21-11-15-7-16(12-21)9-17(8-15)13-21/h2-6,15-18H,7-13H2,1H3,(H,22,24)/t15?,16?,17?,18-,21?/m0/s1