2,2-dimethylpropanoyloxymethyl 6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]oxyhexanoate

Systemtic Name: 2,2-dimethylpropanoyloxymethyl 6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]oxyhexanoate Openeye Name: 2,2-dimethylpropanoyloxymethyl 6-[[6-(1,3-benzoxazol-2-yl)-2-naphthyl]oxy]hexanoate CAS Name: 6-[[6-(1,3-benzoxazol-2-yl)-2-naphthalenyl]oxy]hexanoic acid (2,2-dimethyl-1-oxopropoxy)methyl ester IUPAC Name: 2,2-dimethylpropanoyloxymethyl 6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]oxyhexanoate Traditional Name: 6-[6-(1,3-benzoxazol-2-yl)-2-naphthoxy]hexanoic acid pivaloyloxymethyl ester Formula: C29H31NO6 MolecularWeight: 489.55954

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCOC(=O)CCCCCOC1=CC2=C(C=C1)C=C(C=C2)C3=NC4=CC=CC=C4O3

Isomeric SMILES

CC(C)(C)C(=O)OCOC(=O)CCCCCOC1=CC2=C(C=C1)C=C(C=C2)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C29H31NO6/c1-29(2,3)28(32)35-19-34-26(31)11-5-4-8-16-33-23-15-14-20-17-22(13-12-21(20)18-23)27-30-24-9-6-7-10-25(24)36-27/h6-7,9-10,12-15,17-18H,4-5,8,11,16,19H2,1-3H3