(E)-13-[3-(dimethylamino)phenoxy]-8-(1-hydroxyethyl)-12-oxidanyl-tridec-5-enoic acid

Systemtic Name: (E)-13-[3-(dimethylamino)phenoxy]-8-(1-hydroxyethyl)-12-oxidanyl-tridec-5-enoic acid Openeye Name: (E)-13-[3-(dimethylamino)phenoxy]-12-hydroxy-8-(1-hydroxyethyl)tridec-5-enoic acid CAS Name: (E)-13-[3-(dimethylamino)phenoxy]-12-hydroxy-8-(1-hydroxyethyl)-5-tridecenoic acid IUPAC Name: (E)-13-[3-(dimethylamino)phenoxy]-12-hydroxy-8-(1-hydroxyethyl)tridec-5-enoic acid Traditional Name: (E)-13-[3-(dimethylamino)phenoxy]-12-hydroxy-8-(1-hydroxyethyl)tridec-5-enoic acid Formula: C23H37NO5 MolecularWeight: 407.54358

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CCCC(COC1=CC=CC(=C1)N(C)C)O)CC=CCCCC(=O)O)O

Isomeric SMILES

CC(C(CCCC(COC1=CC=CC(=C1)N(C)C)O)C/C=C/CCCC(=O)O)O

InChI

InChI=1S/C23H37NO5/c1-18(25)19(10-6-4-5-7-15-23(27)28)11-8-13-21(26)17-29-22-14-9-12-20(16-22)24(2)3/h4,6,9,12,14,16,18-19,21,25-26H,5,7-8,10-11,13,15,17H2,1-3H3,(H,27,28)/b6-4+