4-[4-pyridin-3-yl-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)butoxy]benzoic acid

Systemtic Name: 4-[4-pyridin-3-yl-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)butoxy]benzoic acid Openeye Name: 4-[4-(3-pyridyl)-2-(1,1,4,4-tetramethyltetralin-6-yl)butoxy]benzoic acid CAS Name: 4-[4-(3-pyridinyl)-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)butoxy]benzoic acid IUPAC Name: 4-[4-pyridin-3-yl-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)butoxy]benzoic acid Traditional Name: 4-[4-(3-pyridyl)-2-(1,1,4,4-tetramethyltetralin-6-yl)butoxy]benzoic acid Formula: C30H35NO3 MolecularWeight: 457.6038

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C2=C1C=CC(=C2)C(CCC3=CN=CC=C3)COC4=CC=C(C=C4)C(=O)O)(C)C)C

Isomeric SMILES

CC1(CCC(C2=C1C=CC(=C2)C(CCC3=CN=CC=C3)COC4=CC=C(C=C4)C(=O)O)(C)C)C

InChI

InChI=1S/C30H35NO3/c1-29(2)15-16-30(3,4)27-18-23(11-14-26(27)29)24(8-7-21-6-5-17-31-19-21)20-34-25-12-9-22(10-13-25)28(32)33/h5-6,9-14,17-19,24H,7-8,15-16,20H2,1-4H3,(H,32,33)