[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl] 2-(2-oxidanylideneazepan-1-yl)ethanoate

Systemtic Name: [2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl] 2-(2-oxidanylideneazepan-1-yl)ethanoate Openeye Name: [2-(1,3-benzodioxol-5-yl)-2-oxo-ethyl] 2-(2-oxoazepan-1-yl)acetate CAS Name: 2-(2-oxo-1-azepanyl)acetic acid [2-(1,3-benzodioxol-5-yl)-2-oxoethyl] ester IUPAC Name: [2-(1,3-benzodioxol-5-yl)-2-oxoethyl] 2-(2-oxoazepan-1-yl)acetate Traditional Name: 2-(2-ketoazepan-1-yl)acetic acid [2-(1,3-benzodioxol-5-yl)-2-keto-ethyl] ester Formula: C17H19NO6 MolecularWeight: 333.33586

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CC(=O)OCC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1CCC(=O)N(CC1)CC(=O)OCC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H19NO6/c19-13(12-5-6-14-15(8-12)24-11-23-14)10-22-17(21)9-18-7-3-1-2-4-16(18)20/h5-6,8H,1-4,7,9-11H2