methyl 4-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)pyrazol-1-yl]benzoate

Systemtic Name: methyl 4-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)pyrazol-1-yl]benzoate Openeye Name: methyl 4-[4-(1,1,4,4-tetramethyltetralin-6-yl)pyrazol-1-yl]benzoate CAS Name: 4-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1-pyrazolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)pyrazol-1-yl]benzoate Traditional Name: 4-[4-(1,1,4,4-tetramethyltetralin-6-yl)pyrazol-1-yl]benzoic acid methyl ester Formula: C25H28N2O2 MolecularWeight: 388.50202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C2=C1C=CC(=C2)C3=CN(N=C3)C4=CC=C(C=C4)C(=O)OC)(C)C)C

Isomeric SMILES

CC1(CCC(C2=C1C=CC(=C2)C3=CN(N=C3)C4=CC=C(C=C4)C(=O)OC)(C)C)C

InChI

InChI=1S/C25H28N2O2/c1-24(2)12-13-25(3,4)22-14-18(8-11-21(22)24)19-15-26-27(16-19)20-9-6-17(7-10-20)23(28)29-5/h6-11,14-16H,12-13H2,1-5H3