3-[3-(dimethylamino)-2-methyl-propanoyl]oxybutan-2-yl (E)-2-methylhenicos-11-enoate

Systemtic Name: 3-[3-(dimethylamino)-2-methyl-propanoyl]oxybutan-2-yl (E)-2-methylhenicos-11-enoate Openeye Name: [2-[3-(dimethylamino)-2-methyl-propanoyl]oxy-1-methyl-propyl] (E)-2-methylhenicos-11-enoate CAS Name: (E)-2-methyl-11-heneicosenoic acid 3-[3-(dimethylamino)-2-methyl-1-oxopropoxy]butan-2-yl ester IUPAC Name: 3-[3-(dimethylamino)-2-methylpropanoyl]oxybutan-2-yl (E)-2-methylhenicos-11-enoate Traditional Name: (E)-2-methylheneicos-11-enoic acid [2-[3-(dimethylamino)-2-methyl-propanoyl]oxy-1-methyl-propyl] ester Formula: C32H61NO4 MolecularWeight: 523.83104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC=CCCCCCCCCC(C)C(=O)OC(C)C(C)OC(=O)C(C)CN(C)C

Isomeric SMILES

CCCCCCCCC/C=C/CCCCCCCCC(C)C(=O)OC(C)C(C)OC(=O)C(C)CN(C)C

InChI

InChI=1S/C32H61NO4/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-27(2)31(34)36-29(4)30(5)37-32(35)28(3)26-33(6)7/h16-17,27-30H,8-15,18-26H2,1-7H3/b17-16+