octadecanoic acid; (Z)-octadec-9-enoic acid

Systemtic Name: octadecanoic acid; (Z)-octadec-9-enoic acid Openeye Name: (Z)-octadec-9-enoic acid; stearic acid CAS Name: octadecanoic acid; (Z)-9-octadecenoic acid IUPAC Name: octadecanoic acid; (Z)-octadec-9-enoic acid Traditional Name: oleic acid; stearic acid Formula: C36H70O4 MolecularWeight: 566.9386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)O.CCCCCCCCC=CCCCCCCCC(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)O.CCCCCCCC/C=C\CCCCCCCC(=O)O

InChI

InChI=1S/C18H36O2.C18H34O2/c2*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2-17H2,1H3,(H,19,20);9-10H,2-8,11-17H2,1H3,(H,19,20)/b;10-9-