4-methyl-4-(3-methylphenyl)-2-[[(5-oxidanyl-2-adamantyl)amino]methyl]-3-oxidanylidene-pentanoic acid

Systemtic Name: 4-methyl-4-(3-methylphenyl)-2-[[(5-oxidanyl-2-adamantyl)amino]methyl]-3-oxidanylidene-pentanoic acid Openeye Name: 2-[[(5-hydroxy-2-adamantyl)amino]methyl]-4-methyl-4-(m-tolyl)-3-oxo-pentanoic acid CAS Name: 2-[[(5-hydroxy-2-adamantyl)amino]methyl]-4-methyl-4-(3-methylphenyl)-3-oxopentanoic acid IUPAC Name: 2-[[(5-hydroxy-2-adamantyl)amino]methyl]-4-methyl-4-(3-methylphenyl)-3-oxopentanoic acid Traditional Name: 2-[[(5-hydroxy-2-adamantyl)amino]methyl]-3-keto-4-methyl-4-(m-tolyl)valeric acid Formula: C24H33NO4 MolecularWeight: 399.52312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C)(C)C(=O)C(CNC2C3CC4CC2CC(C4)(C3)O)C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)C(C)(C)C(=O)C(CNC2C3CC4CC2CC(C4)(C3)O)C(=O)O

InChI

InChI=1S/C24H33NO4/c1-14-5-4-6-18(7-14)23(2,3)21(26)19(22(27)28)13-25-20-16-8-15-9-17(20)12-24(29,10-15)11-16/h4-7,15-17,19-20,25,29H,8-13H2,1-3H3,(H,27,28)