[2-(azocan-1-yl)-2-oxidanylidene-ethyl] 4-acetamidobenzoate

Systemtic Name: [2-(azocan-1-yl)-2-oxidanylidene-ethyl] 4-acetamidobenzoate Openeye Name: [2-(azocan-1-yl)-2-oxo-ethyl] 4-acetamidobenzoate CAS Name: 4-acetamidobenzoic acid [2-(1-azocanyl)-2-oxoethyl] ester IUPAC Name: [2-(azocan-1-yl)-2-oxoethyl] 4-acetamidobenzoate Traditional Name: 4-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=C(C=C1)C(=O)OCC(=O)N2CCCCCCC2

Isomeric SMILES

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

InChI

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