2-[4-ethoxycarbonyl-1,3-bis(oxidanylidene)-2-phenethyl-pyrrolo[1,2-a]pyrazin-4-yl]ethanoic acid

Systemtic Name: 2-[4-ethoxycarbonyl-1,3-bis(oxidanylidene)-2-phenethyl-pyrrolo[1,2-a]pyrazin-4-yl]ethanoic acid Openeye Name: 2-(4-ethoxycarbonyl-1,3-dioxo-2-phenethyl-pyrrolo[1,2-a]pyrazin-4-yl)acetic acid CAS Name: 2-(4-ethoxycarbonyl-1,3-dioxo-2-phenethyl-4-pyrrolo[1,2-a]pyrazinyl)acetic acid IUPAC Name: 2-(4-ethoxycarbonyl-1,3-dioxo-2-phenethylpyrrolo[1,2-a]pyrazin-4-yl)acetic acid Traditional Name: 2-(4-carbethoxy-1,3-diketo-2-phenethyl-pyrrolo[1,2-a]pyrazin-4-yl)acetic acid Formula: C20H20N2O6 MolecularWeight: 384.3826

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(=O)N(C(=O)C2=CC=CN21)CCC3=CC=CC=C3)CC(=O)O

Isomeric SMILES

CCOC(=O)C1(C(=O)N(C(=O)C2=CC=CN21)CCC3=CC=CC=C3)CC(=O)O

InChI

InChI=1S/C20H20N2O6/c1-2-28-19(27)20(13-16(23)24)18(26)21(12-10-14-7-4-3-5-8-14)17(25)15-9-6-11-22(15)20/h3-9,11H,2,10,12-13H2,1H3,(H,23,24)