(5-methylpyrazin-2-yl)methyl 2,2-dimethyl-6-[4-(4-phenylbutyl)phenoxy]hexanoate

Systemtic Name: (5-methylpyrazin-2-yl)methyl 2,2-dimethyl-6-[4-(4-phenylbutyl)phenoxy]hexanoate Openeye Name: (5-methylpyrazin-2-yl)methyl 2,2-dimethyl-6-[4-(4-phenylbutyl)phenoxy]hexanoate CAS Name: 2,2-dimethyl-6-[4-(4-phenylbutyl)phenoxy]hexanoic acid (5-methyl-2-pyrazinyl)methyl ester IUPAC Name: (5-methylpyrazin-2-yl)methyl 2,2-dimethyl-6-[4-(4-phenylbutyl)phenoxy]hexanoate Traditional Name: 2,2-dimethyl-6-[4-(4-phenylbutyl)phenoxy]hexanoic acid (5-methylpyrazin-2-yl)methyl ester Formula: C30H38N2O3 MolecularWeight: 474.63432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=N1)COC(=O)C(C)(C)CCCCOC2=CC=C(C=C2)CCCCC3=CC=CC=C3

Isomeric SMILES

CC1=CN=C(C=N1)COC(=O)C(C)(C)CCCCOC2=CC=C(C=C2)CCCCC3=CC=CC=C3

InChI

InChI=1S/C30H38N2O3/c1-24-21-32-27(22-31-24)23-35-29(33)30(2,3)19-9-10-20-34-28-17-15-26(16-18-28)14-8-7-13-25-11-5-4-6-12-25/h4-6,11-12,15-18,21-22H,7-10,13-14,19-20,23H2,1-3H3