2-[(4-hexoxyphenyl)carbonylamino]pentanoic acid

Systemtic Name: 2-[(4-hexoxyphenyl)carbonylamino]pentanoic acid Openeye Name: 2-[(4-hexoxybenzoyl)amino]pentanoic acid CAS Name: 2-[[(4-hexoxyphenyl)-oxomethyl]amino]pentanoic acid IUPAC Name: 2-[(4-hexoxybenzoyl)amino]pentanoic acid Traditional Name: 2-[(4-hexoxybenzoyl)amino]valeric acid Formula: C18H27NO4 MolecularWeight: 321.41128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NC(CCC)C(=O)O

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NC(CCC)C(=O)O

InChI

InChI=1S/C18H27NO4/c1-3-5-6-7-13-23-15-11-9-14(10-12-15)17(20)19-16(8-4-2)18(21)22/h9-12,16H,3-8,13H2,1-2H3,(H,19,20)(H,21,22)