[(3S)-1-[5-(3-methyl-3-oxidanyl-but-1-ynyl)furan-2-yl]carbonylpiperidin-3-yl]-naphthalen-2-yl-methanone

Systemtic Name: [(3S)-1-[5-(3-methyl-3-oxidanyl-but-1-ynyl)furan-2-yl]carbonylpiperidin-3-yl]-naphthalen-2-yl-methanone Openeye Name: [(3S)-1-[5-(3-hydroxy-3-methyl-but-1-ynyl)furan-2-carbonyl]-3-piperidyl]-(2-naphthyl)methanone CAS Name: [(3S)-1-[[5-(3-hydroxy-3-methylbut-1-ynyl)-2-furanyl]-oxomethyl]-3-piperidinyl]-(2-naphthalenyl)methanone IUPAC Name: [(3S)-1-[5-(3-hydroxy-3-methylbut-1-ynyl)furan-2-carbonyl]piperidin-3-yl]-naphthalen-2-ylmethanone Traditional Name: [(3S)-1-[5-(3-hydroxy-3-methyl-but-1-ynyl)-2-furoyl]-3-piperidyl]-(2-naphthyl)methanone Formula: C26H25NO4 MolecularWeight: 415.481

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC1=CC=C(O1)C(=O)N2CCCC(C2)C(=O)C3=CC4=CC=CC=C4C=C3)O

Isomeric SMILES

CC(C)(C#CC1=CC=C(O1)C(=O)N2CCC[C@@H](C2)C(=O)C3=CC4=CC=CC=C4C=C3)O

InChI

InChI=1S/C26H25NO4/c1-26(2,30)14-13-22-11-12-23(31-22)25(29)27-15-5-8-21(17-27)24(28)20-10-9-18-6-3-4-7-19(18)16-20/h3-4,6-7,9-12,16,21,30H,5,8,15,17H2,1-2H3/t21-/m0/s1