(3R,4R,5S)-4-(4-hexanoylnaphthalen-1-yl)-5-(hydroxymethyl)-3-propan-2-yl-pyrrolidin-2-one

Systemtic Name: (3R,4R,5S)-4-(4-hexanoylnaphthalen-1-yl)-5-(hydroxymethyl)-3-propan-2-yl-pyrrolidin-2-one Openeye Name: (3R,4R,5S)-4-(4-hexanoyl-1-naphthyl)-5-(hydroxymethyl)-3-isopropyl-pyrrolidin-2-one CAS Name: (3R,4R,5S)-5-(hydroxymethyl)-4-[4-(1-oxohexyl)-1-naphthalenyl]-3-propan-2-yl-2-pyrrolidinone IUPAC Name: (3R,4R,5S)-4-(4-hexanoylnaphthalen-1-yl)-5-(hydroxymethyl)-3-propan-2-ylpyrrolidin-2-one Traditional Name: (3R,4R,5S)-4-(4-caproyl-1-naphthyl)-3-isopropyl-5-methylol-2-pyrrolidone Formula: C24H31NO3 MolecularWeight: 381.50784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C1=CC=C(C2=CC=CC=C21)C3C(NC(=O)C3C(C)C)CO

Isomeric SMILES

CCCCCC(=O)C1=CC=C(C2=CC=CC=C21)[C@@H]3[C@H](NC(=O)[C@@H]3C(C)C)CO

InChI

InChI=1S/C24H31NO3/c1-4-5-6-11-21(27)18-12-13-19(17-10-8-7-9-16(17)18)23-20(14-26)25-24(28)22(23)15(2)3/h7-10,12-13,15,20,22-23,26H,4-6,11,14H2,1-3H3,(H,25,28)/t20-,22-,23-/m1/s1