2-[1-(2-methoxyethyl)-2-oxidanylidene-6-phenyl-azepan-3-yl]ethanoic acid

Systemtic Name: 2-[1-(2-methoxyethyl)-2-oxidanylidene-6-phenyl-azepan-3-yl]ethanoic acid Openeye Name: 2-[1-(2-methoxyethyl)-2-oxo-6-phenyl-azepan-3-yl]acetic acid CAS Name: 2-[1-(2-methoxyethyl)-2-oxo-6-phenyl-3-azepanyl]acetic acid IUPAC Name: 2-[1-(2-methoxyethyl)-2-oxo-6-phenylazepan-3-yl]acetic acid Traditional Name: 2-[2-keto-1-(2-methoxyethyl)-6-phenyl-azepan-3-yl]acetic acid Formula: C17H23NO4 MolecularWeight: 305.36882

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1CC(CCC(C1=O)CC(=O)O)C2=CC=CC=C2

Isomeric SMILES

COCCN1CC(CCC(C1=O)CC(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C17H23NO4/c1-22-10-9-18-12-15(13-5-3-2-4-6-13)8-7-14(17(18)21)11-16(19)20/h2-6,14-15H,7-12H2,1H3,(H,19,20)