2-[2,2-dimethyl-3-oxidanylidene-3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]-4,6-dimethyl-benzoic acid

Systemtic Name: 2-[2,2-dimethyl-3-oxidanylidene-3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]-4,6-dimethyl-benzoic acid Openeye Name: 2-[2,2-dimethyl-3-oxo-3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]-4,6-dimethyl-benzoic acid CAS Name: 2-[2,2-dimethyl-3-oxo-3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]-4,6-dimethylbenzoic acid IUPAC Name: 2-[2,2-dimethyl-3-oxo-3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]-4,6-dimethylbenzoic acid Traditional Name: 2-[3-keto-2,2-dimethyl-3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]-4,6-dimethyl-benzoic acid Formula: C25H29NO3 MolecularWeight: 391.50266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)CC(C)(C)C(=O)N2CCC(=CC2)C3=CC=CC=C3)C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)CC(C)(C)C(=O)N2CCC(=CC2)C3=CC=CC=C3)C(=O)O)C

InChI

InChI=1S/C25H29NO3/c1-17-14-18(2)22(23(27)28)21(15-17)16-25(3,4)24(29)26-12-10-20(11-13-26)19-8-6-5-7-9-19/h5-10,14-15H,11-13,16H2,1-4H3,(H,27,28)