sodium 4-[(2-pentoxyphenyl)carbonylamino]butanoate

Systemtic Name: sodium 4-[(2-pentoxyphenyl)carbonylamino]butanoate Openeye Name: sodium 4-[(2-pentoxybenzoyl)amino]butanoate CAS Name: sodium 4-[[oxo-(2-pentoxyphenyl)methyl]amino]butanoate IUPAC Name: sodium 4-[(2-pentoxybenzoyl)amino]butanoate Traditional Name: sodium 4-[(2-amoxybenzoyl)amino]butyrate Formula: C16H22NNaO4 MolecularWeight: 315.33995

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC=C1C(=O)NCCCC(=O)[O-].[Na+]

Isomeric SMILES

CCCCCOC1=CC=CC=C1C(=O)NCCCC(=O)[O-].[Na+]

InChI

InChI=1S/C16H23NO4.Na/c1-2-3-6-12-21-14-9-5-4-8-13(14)16(20)17-11-7-10-15(18)19;/h4-5,8-9H,2-3,6-7,10-12H2,1H3,(H,17,20)(H,18,19);/q;+1/p-1