4-[[1-(1-adamantylcarbonyl)piperidin-4-ylidene]methyl]benzoic acid

Systemtic Name: 4-[[1-(1-adamantylcarbonyl)piperidin-4-ylidene]methyl]benzoic acid Openeye Name: 4-[[1-(adamantane-1-carbonyl)-4-piperidylidene]methyl]benzoic acid CAS Name: 4-[[1-[1-adamantyl(oxo)methyl]-4-piperidinylidene]methyl]benzoic acid IUPAC Name: 4-[[1-(adamantane-1-carbonyl)piperidin-4-ylidene]methyl]benzoic acid Traditional Name: 4-[[1-(adamantane-1-carbonyl)-4-piperidylidene]methyl]benzoic acid Formula: C24H29NO3 MolecularWeight: 379.49196

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1=CC2=CC=C(C=C2)C(=O)O)C(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CN(CCC1=CC2=CC=C(C=C2)C(=O)O)C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H29NO3/c26-22(27)21-3-1-16(2-4-21)9-17-5-7-25(8-6-17)23(28)24-13-18-10-19(14-24)12-20(11-18)15-24/h1-4,9,18-20H,5-8,10-15H2,(H,26,27)