methyl 3-[2-(1-adamantyl)ethanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl 3-[2-(1-adamantyl)ethanoylamino]-3-phenyl-propanoate Openeye Name: methyl 3-[[2-(1-adamantyl)acetyl]amino]-3-phenyl-propanoate CAS Name: 3-[[2-(1-adamantyl)-1-oxoethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 3-[[2-(1-adamantyl)acetyl]amino]-3-phenylpropanoate Traditional Name: 3-[[2-(1-adamantyl)acetyl]amino]-3-phenyl-propionic acid methyl ester Formula: C22H29NO3 MolecularWeight: 355.47056

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CC=C1)NC(=O)CC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

COC(=O)CC(C1=CC=CC=C1)NC(=O)CC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H29NO3/c1-26-21(25)10-19(18-5-3-2-4-6-18)23-20(24)14-22-11-15-7-16(12-22)9-17(8-15)13-22/h2-6,15-17,19H,7-14H2,1H3,(H,23,24)