2-(pentylcarbamoylamino)benzoic acid

Systemtic Name: 2-(pentylcarbamoylamino)benzoic acid Openeye Name: 2-(pentylcarbamoylamino)benzoic acid CAS Name: 2-[[oxo-(pentylamino)methyl]amino]benzoic acid IUPAC Name: 2-(pentylcarbamoylamino)benzoic acid Traditional Name: 2-(amylcarbamoylamino)benzoic acid Formula: C13H18N2O3 MolecularWeight: 250.29362

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)NC1=CC=CC=C1C(=O)O

Isomeric SMILES

CCCCCNC(=O)NC1=CC=CC=C1C(=O)O

InChI

InChI=1S/C13H18N2O3/c1-2-3-6-9-14-13(18)15-11-8-5-4-7-10(11)12(16)17/h4-5,7-8H,2-3,6,9H2,1H3,(H,16,17)(H2,14,15,18)