(E)-4-[3-(2-cyanopyrrol-1-yl)phenyl]carbonyloxy-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[3-(2-cyanopyrrol-1-yl)phenyl]carbonyloxy-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[3-(2-cyanopyrrol-1-yl)benzoyl]oxy-4-oxo-but-2-enoic acid CAS Name: (E)-4-[[3-(2-cyano-1-pyrrolyl)phenyl]-oxomethoxy]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[3-(2-cyanopyrrol-1-yl)benzoyl]oxy-4-oxobut-2-enoic acid Traditional Name: (E)-4-[3-(2-cyanopyrrol-1-yl)benzoyl]oxy-4-keto-but-2-enoic acid Formula: C16H10N2O5 MolecularWeight: 310.261

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N2C=CC=C2C#N)C(=O)OC(=O)C=CC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)N2C=CC=C2C#N)C(=O)OC(=O)/C=C/C(=O)O

InChI

InChI=1S/C16H10N2O5/c17-10-13-5-2-8-18(13)12-4-1-3-11(9-12)16(22)23-15(21)7-6-14(19)20/h1-9H,(H,19,20)/b7-6+