[1-[3-(3-methyl-3-oxidanyl-but-1-ynyl)phenyl]carbonylpiperidin-3-yl]-naphthalen-2-yl-methanone

Systemtic Name: [1-[3-(3-methyl-3-oxidanyl-but-1-ynyl)phenyl]carbonylpiperidin-3-yl]-naphthalen-2-yl-methanone Openeye Name: [1-[3-(3-hydroxy-3-methyl-but-1-ynyl)benzoyl]-3-piperidyl]-(2-naphthyl)methanone CAS Name: [1-[[3-(3-hydroxy-3-methylbut-1-ynyl)phenyl]-oxomethyl]-3-piperidinyl]-(2-naphthalenyl)methanone IUPAC Name: [1-[3-(3-hydroxy-3-methylbut-1-ynyl)benzoyl]piperidin-3-yl]-naphthalen-2-ylmethanone Traditional Name: [1-[3-(3-hydroxy-3-methyl-but-1-ynyl)benzoyl]-3-piperidyl]-(2-naphthyl)methanone Formula: C28H27NO3 MolecularWeight: 425.51888

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC1=CC(=CC=C1)C(=O)N2CCCC(C2)C(=O)C3=CC4=CC=CC=C4C=C3)O

Isomeric SMILES

CC(C)(C#CC1=CC(=CC=C1)C(=O)N2CCCC(C2)C(=O)C3=CC4=CC=CC=C4C=C3)O

InChI

InChI=1S/C28H27NO3/c1-28(2,32)15-14-20-7-5-10-24(17-20)27(31)29-16-6-11-25(19-29)26(30)23-13-12-21-8-3-4-9-22(21)18-23/h3-5,7-10,12-13,17-18,25,32H,6,11,16,19H2,1-2H3