ethyl 2-[1-(1,3-benzodioxol-5-yl)-2-nitro-ethyl]-3-oxidanylidene-5-(2-oxidanylidenepyrrolidin-1-yl)pentanoate

Systemtic Name: ethyl 2-[1-(1,3-benzodioxol-5-yl)-2-nitro-ethyl]-3-oxidanylidene-5-(2-oxidanylidenepyrrolidin-1-yl)pentanoate Openeye Name: ethyl 2-[1-(1,3-benzodioxol-5-yl)-2-nitro-ethyl]-3-oxo-5-(2-oxopyrrolidin-1-yl)pentanoate CAS Name: 2-[1-(1,3-benzodioxol-5-yl)-2-nitroethyl]-3-oxo-5-(2-oxo-1-pyrrolidinyl)pentanoic acid ethyl ester IUPAC Name: ethyl 2-[1-(1,3-benzodioxol-5-yl)-2-nitroethyl]-3-oxo-5-(2-oxopyrrolidin-1-yl)pentanoate Traditional Name: 2-[1-(1,3-benzodioxol-5-yl)-2-nitro-ethyl]-3-keto-5-(2-ketopyrrolidino)valeric acid ethyl ester Formula: C20H24N2O8 MolecularWeight: 420.41316

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C[N+](=O)[O-])C1=CC2=C(C=C1)OCO2)C(=O)CCN3CCCC3=O

Isomeric SMILES

CCOC(=O)C(C(C[N+](=O)[O-])C1=CC2=C(C=C1)OCO2)C(=O)CCN3CCCC3=O

InChI

InChI=1S/C20H24N2O8/c1-2-28-20(25)19(15(23)7-9-21-8-3-4-18(21)24)14(11-22(26)27)13-5-6-16-17(10-13)30-12-29-16/h5-6,10,14,19H,2-4,7-9,11-12H2,1H3