4-(2-azanyl-1-oxidanyl-1-oxidanylidene-heptan-2-yl)benzoic acid

Systemtic Name: 4-(2-azanyl-1-oxidanyl-1-oxidanylidene-heptan-2-yl)benzoic acid Openeye Name: 4-(1-amino-1-carboxy-hexyl)benzoic acid CAS Name: 4-(2-amino-1-hydroxy-1-oxoheptan-2-yl)benzoic acid IUPAC Name: 4-(2-amino-1-hydroxy-1-oxoheptan-2-yl)benzoic acid Traditional Name: 4-(1-amino-1-carboxy-hexyl)benzoic acid Formula: C14H19NO4 MolecularWeight: 265.30496

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=CC=C(C=C1)C(=O)O)(C(=O)O)N

Isomeric SMILES

CCCCCC(C1=CC=C(C=C1)C(=O)O)(C(=O)O)N

InChI

InChI=1S/C14H19NO4/c1-2-3-4-9-14(15,13(18)19)11-7-5-10(6-8-11)12(16)17/h5-8H,2-4,9,15H2,1H3,(H,16,17)(H,18,19)