1-[3-(dimethylamino)-2-methyl-propanoyl]oxypropan-2-yl (E)-henicos-11-enoate

Systemtic Name: 1-[3-(dimethylamino)-2-methyl-propanoyl]oxypropan-2-yl (E)-henicos-11-enoate Openeye Name: [2-[3-(dimethylamino)-2-methyl-propanoyl]oxy-1-methyl-ethyl] (E)-henicos-11-enoate CAS Name: (E)-11-heneicosenoic acid 1-[3-(dimethylamino)-2-methyl-1-oxopropoxy]propan-2-yl ester IUPAC Name: 1-[3-(dimethylamino)-2-methylpropanoyl]oxypropan-2-yl (E)-henicos-11-enoate Traditional Name: (E)-heneicos-11-enoic acid [2-[3-(dimethylamino)-2-methyl-propanoyl]oxy-1-methyl-ethyl] ester Formula: C30H57NO4 MolecularWeight: 495.77788

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H57NO4/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-29(32)35-28(3)26-34-30(33)27(2)25-31(4)5/h14-15,27-28H,6-13,16-26H2,1-5H3/b15-14+