3-(4-aminophenyl)adamantane-1-carboxylic acid

Systemtic Name: 3-(4-aminophenyl)adamantane-1-carboxylic acid Openeye Name: 3-(4-aminophenyl)adamantane-1-carboxylic acid CAS Name: 3-(4-aminophenyl)-1-adamantanecarboxylic acid IUPAC Name: 3-(4-aminophenyl)adamantane-1-carboxylic acid Traditional Name: 3-(4-aminophenyl)adamantane-1-carboxylic acid Formula: C17H21NO2 MolecularWeight: 271.35414

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)C(=O)O)C4=CC=C(C=C4)N

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)C(=O)O)C4=CC=C(C=C4)N

InChI

InChI=1S/C17H21NO2/c18-14-3-1-13(2-4-14)16-6-11-5-12(7-16)9-17(8-11,10-16)15(19)20/h1-4,11-12H,5-10,18H2,(H,19,20)