(2-imidazol-1-yl-1-naphthalen-1-yl-ethyl) hexanoate

Systemtic Name: (2-imidazol-1-yl-1-naphthalen-1-yl-ethyl) hexanoate Openeye Name: [2-imidazol-1-yl-1-(1-naphthyl)ethyl] hexanoate CAS Name: hexanoic acid [2-(1-imidazolyl)-1-(1-naphthalenyl)ethyl] ester IUPAC Name: (2-imidazol-1-yl-1-naphthalen-1-ylethyl) hexanoate Traditional Name: hexanoic acid [2-imidazol-1-yl-1-(1-naphthyl)ethyl] ester Formula: C21H24N2O2 MolecularWeight: 336.42746

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC(CN1C=CN=C1)C2=CC=CC3=CC=CC=C32

Isomeric SMILES

CCCCCC(=O)OC(CN1C=CN=C1)C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C21H24N2O2/c1-2-3-4-12-21(24)25-20(15-23-14-13-22-16-23)19-11-7-9-17-8-5-6-10-18(17)19/h5-11,13-14,16,20H,2-4,12,15H2,1H3