2-(1-adamantylcarbonylamino)-3-(4-hydroxyphenyl)propanoic acid

Systemtic Name: 2-(1-adamantylcarbonylamino)-3-(4-hydroxyphenyl)propanoic acid Openeye Name: 2-(adamantane-1-carbonylamino)-3-(4-hydroxyphenyl)propanoic acid CAS Name: 2-[[1-adamantyl(oxo)methyl]amino]-3-(4-hydroxyphenyl)propanoic acid IUPAC Name: 2-(adamantane-1-carbonylamino)-3-(4-hydroxyphenyl)propanoic acid Traditional Name: 2-(adamantane-1-carbonylamino)-3-(4-hydroxyphenyl)propionic acid Formula: C20H25NO4 MolecularWeight: 343.4168

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NC(CC4=CC=C(C=C4)O)C(=O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NC(CC4=CC=C(C=C4)O)C(=O)O

InChI

InChI=1S/C20H25NO4/c22-16-3-1-12(2-4-16)8-17(18(23)24)21-19(25)20-9-13-5-14(10-20)7-15(6-13)11-20/h1-4,13-15,17,22H,5-11H2,(H,21,25)(H,23,24)