4-[(decanoylamino)methyl]benzoic acid

Systemtic Name: 4-[(decanoylamino)methyl]benzoic acid Openeye Name: 4-[(decanoylamino)methyl]benzoic acid CAS Name: 4-[(1-oxodecylamino)methyl]benzoic acid IUPAC Name: 4-[(decanoylamino)methyl]benzoic acid Traditional Name: 4-[(caprylamino)methyl]benzoic acid Formula: C18H27NO3 MolecularWeight: 305.41188

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)NCC1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CCCCCCCCCC(=O)NCC1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C18H27NO3/c1-2-3-4-5-6-7-8-9-17(20)19-14-15-10-12-16(13-11-15)18(21)22/h10-13H,2-9,14H2,1H3,(H,19,20)(H,21,22)