4-[5-(azepan-1-yl)-2-oxidanylidene-pyridin-1-yl]butanoic acid

Systemtic Name: 4-[5-(azepan-1-yl)-2-oxidanylidene-pyridin-1-yl]butanoic acid Openeye Name: 4-[5-(azepan-1-yl)-2-oxo-1-pyridyl]butanoic acid CAS Name: 4-[5-(1-azepanyl)-2-oxo-1-pyridinyl]butanoic acid IUPAC Name: 4-[5-(azepan-1-yl)-2-oxopyridin-1-yl]butanoic acid Traditional Name: 4-[5-(azepan-1-yl)-2-keto-1-pyridyl]butyric acid Formula: C15H22N2O3 MolecularWeight: 278.34678

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CN(C(=O)C=C2)CCCC(=O)O

Isomeric SMILES

C1CCCN(CC1)C2=CN(C(=O)C=C2)CCCC(=O)O

InChI

InChI=1S/C15H22N2O3/c18-14-8-7-13(16-9-3-1-2-4-10-16)12-17(14)11-5-6-15(19)20/h7-8,12H,1-6,9-11H2,(H,19,20)