4-(4-hept-1-ynylnaphthalen-1-yl)-5-(hydroxymethyl)-3-propan-2-yl-pyrrolidin-2-one

Systemtic Name: 4-(4-hept-1-ynylnaphthalen-1-yl)-5-(hydroxymethyl)-3-propan-2-yl-pyrrolidin-2-one Openeye Name: 4-(4-hept-1-ynyl-1-naphthyl)-5-(hydroxymethyl)-3-isopropyl-pyrrolidin-2-one CAS Name: 4-(4-hept-1-ynyl-1-naphthalenyl)-5-(hydroxymethyl)-3-propan-2-yl-2-pyrrolidinone IUPAC Name: 4-(4-hept-1-ynylnaphthalen-1-yl)-5-(hydroxymethyl)-3-propan-2-ylpyrrolidin-2-one Traditional Name: 4-(4-hept-1-ynyl-1-naphthyl)-3-isopropyl-5-methylol-2-pyrrolidone Formula: C25H31NO2 MolecularWeight: 377.51914

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC#CC1=CC=C(C2=CC=CC=C12)C3C(NC(=O)C3C(C)C)CO

Isomeric SMILES

CCCCCC#CC1=CC=C(C2=CC=CC=C12)C3C(NC(=O)C3C(C)C)CO

InChI

InChI=1S/C25H31NO2/c1-4-5-6-7-8-11-18-14-15-21(20-13-10-9-12-19(18)20)24-22(16-27)26-25(28)23(24)17(2)3/h9-10,12-15,17,22-24,27H,4-7,16H2,1-3H3,(H,26,28)