2-[6-[2-(3,5,5,8,8-pentamethylnaphthalen-2-yl)oxiran-2-yl]pyridin-3-yl]cyclopentane-1,3-dione

Systemtic Name: 2-[6-[2-(3,5,5,8,8-pentamethylnaphthalen-2-yl)oxiran-2-yl]pyridin-3-yl]cyclopentane-1,3-dione Openeye Name: 2-[6-[2-(3,5,5,8,8-pentamethyl-2-naphthyl)oxiran-2-yl]-3-pyridyl]cyclopentane-1,3-dione CAS Name: 2-[6-[2-(3,5,5,8,8-pentamethyl-2-naphthalenyl)-2-oxiranyl]-3-pyridinyl]cyclopentane-1,3-dione IUPAC Name: 2-[6-[2-(3,5,5,8,8-pentamethylnaphthalen-2-yl)oxiran-2-yl]pyridin-3-yl]cyclopentane-1,3-dione Traditional Name: 2-[6-[2-(3,5,5,8,8-pentamethyl-2-naphthyl)oxiran-2-yl]-3-pyridyl]cyclopentane-1,3-quinone Formula: C27H29NO3 MolecularWeight: 415.52406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(C=CC2(C)C)(C)C)C3(CO3)C4=NC=C(C=C4)C5C(=O)CCC5=O

Isomeric SMILES

CC1=C(C=C2C(=C1)C(C=CC2(C)C)(C)C)C3(CO3)C4=NC=C(C=C4)C5C(=O)CCC5=O

InChI

InChI=1S/C27H29NO3/c1-16-12-19-20(26(4,5)11-10-25(19,2)3)13-18(16)27(15-31-27)23-9-6-17(14-28-23)24-21(29)7-8-22(24)30/h6,9-14,24H,7-8,15H2,1-5H3