2-acetyloxy-2-(diethylaminomethyl)-7-[2-[(E)-oct-1-enyl]cyclopentyl]heptanoic acid

Systemtic Name: 2-acetyloxy-2-(diethylaminomethyl)-7-[2-[(E)-oct-1-enyl]cyclopentyl]heptanoic acid Openeye Name: 2-acetoxy-2-(diethylaminomethyl)-7-[2-[(E)-oct-1-enyl]cyclopentyl]heptanoic acid CAS Name: 2-acetyloxy-2-(diethylaminomethyl)-7-[2-[(E)-oct-1-enyl]cyclopentyl]heptanoic acid IUPAC Name: 2-acetyloxy-2-(diethylaminomethyl)-7-[2-[(E)-oct-1-enyl]cyclopentyl]heptanoic acid Traditional Name: 2-acetoxy-2-(diethylaminomethyl)-7-[2-[(E)-oct-1-enyl]cyclopentyl]enanthic acid Formula: C27H49NO4 MolecularWeight: 451.68226

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=CC1CCCC1CCCCCC(CN(CC)CC)(C(=O)O)OC(=O)C

Isomeric SMILES

CCCCCC/C=C/C1CCCC1CCCCCC(CN(CC)CC)(C(=O)O)OC(=O)C

InChI

InChI=1S/C27H49NO4/c1-5-8-9-10-11-13-17-24-19-16-20-25(24)18-14-12-15-21-27(26(30)31,32-23(4)29)22-28(6-2)7-3/h13,17,24-25H,5-12,14-16,18-22H2,1-4H3,(H,30,31)/b17-13+