[2-(azocan-1-yl)-2-oxidanylidene-ethyl] 3-acetamidobenzoate

Systemtic Name: [2-(azocan-1-yl)-2-oxidanylidene-ethyl] 3-acetamidobenzoate Openeye Name: [2-(azocan-1-yl)-2-oxo-ethyl] 3-acetamidobenzoate CAS Name: 3-acetamidobenzoic acid [2-(1-azocanyl)-2-oxoethyl] ester IUPAC Name: [2-(azocan-1-yl)-2-oxoethyl] 3-acetamidobenzoate Traditional Name: 3-acetamidobenzoic acid [2-(azocan-1-yl)-2-keto-ethyl] ester Formula: C18H24N2O4 MolecularWeight: 332.39416

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)C(=O)OCC(=O)N2CCCCCCC2

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)C(=O)OCC(=O)N2CCCCCCC2

InChI

InChI=1S/C18H24N2O4/c1-14(21)19-16-9-7-8-15(12-16)18(23)24-13-17(22)20-10-5-3-2-4-6-11-20/h7-9,12H,2-6,10-11,13H2,1H3,(H,19,21)