methyl 4-[3-(1,3-benzodioxol-5-ylmethylamino)-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoate

Systemtic Name: methyl 4-[3-(1,3-benzodioxol-5-ylmethylamino)-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoate Openeye Name: methyl 4-[3-(1,3-benzodioxol-5-ylmethylamino)-2,5-dioxo-pyrrolidin-1-yl]benzoate CAS Name: 4-[3-(1,3-benzodioxol-5-ylmethylamino)-2,5-dioxo-1-pyrrolidinyl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(1,3-benzodioxol-5-ylmethylamino)-2,5-dioxopyrrolidin-1-yl]benzoate Traditional Name: 4-[2,5-diketo-3-(piperonylamino)pyrrolidino]benzoic acid methyl ester Formula: C20H18N2O6 MolecularWeight: 382.36672

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H18N2O6/c1-26-20(25)13-3-5-14(6-4-13)22-18(23)9-15(19(22)24)21-10-12-2-7-16-17(8-12)28-11-27-16/h2-8,15,21H,9-11H2,1H3