(2,2,5,7,8-pentamethyl-3,4-dihydrochromen-6-yl) pyridine-3-carboxylate

Systemtic Name: (2,2,5,7,8-pentamethyl-3,4-dihydrochromen-6-yl) pyridine-3-carboxylate Openeye Name: (2,2,5,7,8-pentamethylchroman-6-yl) pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid (2,2,5,7,8-pentamethyl-3,4-dihydro-2H-1-benzopyran-6-yl) ester IUPAC Name: (2,2,5,7,8-pentamethyl-3,4-dihydrochromen-6-yl) pyridine-3-carboxylate Traditional Name: nicotinic acid (2,2,5,7,8-pentamethylchroman-6-yl) ester Formula: C20H23NO3 MolecularWeight: 325.40152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=C1C)OC(=O)C3=CN=CC=C3)C)CCC(O2)(C)C

Isomeric SMILES

CC1=C2C(=C(C(=C1C)OC(=O)C3=CN=CC=C3)C)CCC(O2)(C)C

InChI

InChI=1S/C20H23NO3/c1-12-13(2)18-16(8-9-20(4,5)24-18)14(3)17(12)23-19(22)15-7-6-10-21-11-15/h6-7,10-11H,8-9H2,1-5H3