4-azanyl-3-(2-oxidanylideneazepan-3-yl)oxy-benzoic acid

Systemtic Name: 4-azanyl-3-(2-oxidanylideneazepan-3-yl)oxy-benzoic acid Openeye Name: 4-amino-3-(2-oxoazepan-3-yl)oxy-benzoic acid CAS Name: 4-amino-3-[(2-oxo-3-azepanyl)oxy]benzoic acid IUPAC Name: 4-amino-3-(2-oxoazepan-3-yl)oxybenzoic acid Traditional Name: 4-amino-3-(2-ketoazepan-3-yl)oxy-benzoic acid Formula: C13H16N2O4 MolecularWeight: 264.27714

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)OC2=C(C=CC(=C2)C(=O)O)N

Isomeric SMILES

C1CCNC(=O)C(C1)OC2=C(C=CC(=C2)C(=O)O)N

InChI

InChI=1S/C13H16N2O4/c14-9-5-4-8(13(17)18)7-11(9)19-10-3-1-2-6-15-12(10)16/h4-5,7,10H,1-3,6,14H2,(H,15,16)(H,17,18)