3-[2-[2,7-bis(oxidanylidene)azepan-1-yl]ethoxy]benzoic acid

Systemtic Name: 3-[2-[2,7-bis(oxidanylidene)azepan-1-yl]ethoxy]benzoic acid Openeye Name: 3-[2-(2,7-dioxoazepan-1-yl)ethoxy]benzoic acid CAS Name: 3-[2-(2,7-dioxo-1-azepanyl)ethoxy]benzoic acid IUPAC Name: 3-[2-(2,7-dioxoazepan-1-yl)ethoxy]benzoic acid Traditional Name: 3-[2-(2,7-diketoazepan-1-yl)ethoxy]benzoic acid Formula: C15H17NO5 MolecularWeight: 291.29918

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(C(=O)C1)CCOC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

C1CCC(=O)N(C(=O)C1)CCOC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C15H17NO5/c17-13-6-1-2-7-14(18)16(13)8-9-21-12-5-3-4-11(10-12)15(19)20/h3-5,10H,1-2,6-9H2,(H,19,20)