3-(1-adamantylcarbonylamino)-3-phenyl-propanoic acid

Systemtic Name: 3-(1-adamantylcarbonylamino)-3-phenyl-propanoic acid Openeye Name: 3-(adamantane-1-carbonylamino)-3-phenyl-propanoic acid CAS Name: 3-[[1-adamantyl(oxo)methyl]amino]-3-phenylpropanoic acid IUPAC Name: 3-(adamantane-1-carbonylamino)-3-phenylpropanoic acid Traditional Name: 3-(adamantane-1-carbonylamino)-3-phenyl-propionic acid Formula: C20H25NO3 MolecularWeight: 327.4174

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NC(CC(=O)O)C4=CC=CC=C4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NC(CC(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C20H25NO3/c22-18(23)9-17(16-4-2-1-3-5-16)21-19(24)20-10-13-6-14(11-20)8-15(7-13)12-20/h1-5,13-15,17H,6-12H2,(H,21,24)(H,22,23)