2,2,5,7-tetramethyl-8-(3-pyridin-3-yloxypropyl)-3,4-dihydrochromen-6-ol hydrochloride

Systemtic Name: 2,2,5,7-tetramethyl-8-(3-pyridin-3-yloxypropyl)-3,4-dihydrochromen-6-ol hydrochloride Openeye Name: 2,2,5,7-tetramethyl-8-[3-(3-pyridyloxy)propyl]chroman-6-ol hydrochloride CAS Name: 2,2,5,7-tetramethyl-8-[3-(3-pyridinyloxy)propyl]-3,4-dihydro-2H-1-benzopyran-6-ol hydrochloride IUPAC Name: 2,2,5,7-tetramethyl-8-(3-pyridin-3-yloxypropyl)-3,4-dihydrochromen-6-ol hydrochloride Traditional Name: 2,2,5,7-tetramethyl-8-[3-(3-pyridyloxy)propyl]chroman-6-ol hydrochloride Formula: C21H28ClNO3 MolecularWeight: 377.90492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CCC(OC2=C(C(=C1O)C)CCCOC3=CN=CC=C3)(C)C.Cl

Isomeric SMILES

CC1=C2CCC(OC2=C(C(=C1O)C)CCCOC3=CN=CC=C3)(C)C.Cl

InChI

InChI=1S/C21H27NO3.ClH/c1-14-17(8-6-12-24-16-7-5-11-22-13-16)20-18(15(2)19(14)23)9-10-21(3,4)25-20;/h5,7,11,13,23H,6,8-10,12H2,1-4H3;1H