2-[2-(2-oxidanylideneazepan-1-yl)ethanoylamino]benzoic acid

Systemtic Name: 2-[2-(2-oxidanylideneazepan-1-yl)ethanoylamino]benzoic acid Openeye Name: 2-[[2-(2-oxoazepan-1-yl)acetyl]amino]benzoic acid CAS Name: 2-[[1-oxo-2-(2-oxo-1-azepanyl)ethyl]amino]benzoic acid IUPAC Name: 2-[[2-(2-oxoazepan-1-yl)acetyl]amino]benzoic acid Traditional Name: 2-[[2-(2-ketoazepan-1-yl)acetyl]amino]benzoic acid Formula: C15H18N2O4 MolecularWeight: 290.31442

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CC(=O)NC2=CC=CC=C2C(=O)O

Isomeric SMILES

C1CCC(=O)N(CC1)CC(=O)NC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C15H18N2O4/c18-13(10-17-9-5-1-2-8-14(17)19)16-12-7-4-3-6-11(12)15(20)21/h3-4,6-7H,1-2,5,8-10H2,(H,16,18)(H,20,21)