2-[(2-methoxy-2-oxidanylidene-ethyl)-(3-octadecoxy-5-oxidanyl-phenyl)amino]ethanoic acid

Systemtic Name: 2-[(2-methoxy-2-oxidanylidene-ethyl)-(3-octadecoxy-5-oxidanyl-phenyl)amino]ethanoic acid Openeye Name: 2-(3-hydroxy-N-(2-methoxy-2-oxo-ethyl)-5-octadecoxy-anilino)acetic acid CAS Name: 2-(3-hydroxy-N-(2-methoxy-2-oxoethyl)-5-octadecoxyanilino)acetic acid IUPAC Name: 2-(3-hydroxy-N-(2-methoxy-2-oxoethyl)-5-octadecoxyanilino)acetic acid Traditional Name: 2-(3-hydroxy-N-(2-keto-2-methoxy-ethyl)-5-stearyloxy-anilino)acetic acid Formula: C29H49NO6 MolecularWeight: 507.70246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC(=CC(=C1)O)N(CC(=O)O)CC(=O)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC(=CC(=C1)O)N(CC(=O)O)CC(=O)OC

InChI

InChI=1S/C29H49NO6/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-36-27-21-25(20-26(31)22-27)30(23-28(32)33)24-29(34)35-2/h20-22,31H,3-19,23-24H2,1-2H3,(H,32,33)