1-[2-[(6-ethanoyl-1,3-benzodioxol-5-yl)amino]-2-oxidanylidene-ethyl]cyclohexane-1-carboxylate

Systemtic Name: 1-[2-[(6-ethanoyl-1,3-benzodioxol-5-yl)amino]-2-oxidanylidene-ethyl]cyclohexane-1-carboxylate Openeye Name: 1-[2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-oxo-ethyl]cyclohexanecarboxylate CAS Name: 1-[2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-oxoethyl]-1-cyclohexanecarboxylate IUPAC Name: 1-[2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-oxoethyl]cyclohexane-1-carboxylate Traditional Name: 1-[2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-keto-ethyl]cyclohexanecarboxylate Formula: C18H20NO6- MolecularWeight: 346.3545

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)CC3(CCCCC3)C(=O)[O-])OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)CC3(CCCCC3)C(=O)[O-])OCO2

InChI

InChI=1S/C18H21NO6/c1-11(20)12-7-14-15(25-10-24-14)8-13(12)19-16(21)9-18(17(22)23)5-3-2-4-6-18/h7-8H,2-6,9-10H2,1H3,(H,19,21)(H,22,23)/p-1