2-[[4-(1-adamantyl)phenyl]carbamoyl]benzoic acid

Systemtic Name: 2-[[4-(1-adamantyl)phenyl]carbamoyl]benzoic acid Openeye Name: 2-[[4-(1-adamantyl)phenyl]carbamoyl]benzoic acid CAS Name: 2-[[4-(1-adamantyl)anilino]-oxomethyl]benzoic acid IUPAC Name: 2-[[4-(1-adamantyl)phenyl]carbamoyl]benzoic acid Traditional Name: 2-[[4-(1-adamantyl)phenyl]carbamoyl]benzoic acid Formula: C24H25NO3 MolecularWeight: 375.4602

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)NC(=O)C5=CC=CC=C5C(=O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)NC(=O)C5=CC=CC=C5C(=O)O

InChI

InChI=1S/C24H25NO3/c26-22(20-3-1-2-4-21(20)23(27)28)25-19-7-5-18(6-8-19)24-12-15-9-16(13-24)11-17(10-15)14-24/h1-8,15-17H,9-14H2,(H,25,26)(H,27,28)