(4Z)-3-(1H-indol-4-yl)-4-[(3-methoxy-1H-pyrrol-2-yl)methylidene]-2-oxidanylidene-hex-5-ynoic acid

Systemtic Name: (4Z)-3-(1H-indol-4-yl)-4-[(3-methoxy-1H-pyrrol-2-yl)methylidene]-2-oxidanylidene-hex-5-ynoic acid Openeye Name: (4Z)-3-(1H-indol-4-yl)-4-[(3-methoxy-1H-pyrrol-2-yl)methylene]-2-oxo-hex-5-ynoic acid CAS Name: (4Z)-3-(1H-indol-4-yl)-4-[(3-methoxy-1H-pyrrol-2-yl)methylidene]-2-oxo-5-hexynoic acid IUPAC Name: (4Z)-3-(1H-indol-4-yl)-4-[(3-methoxy-1H-pyrrol-2-yl)methylidene]-2-oxohex-5-ynoic acid Traditional Name: (4Z)-3-(1H-indol-4-yl)-2-keto-4-[(3-methoxy-1H-pyrrol-2-yl)methylene]hex-5-ynoic acid Formula: C20H16N2O4 MolecularWeight: 348.35204

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(NC=C1)C=C(C#C)C(C2=C3C=CNC3=CC=C2)C(=O)C(=O)O

Isomeric SMILES

COC1=C(NC=C1)/C=C(\C#C)/C(C2=C3C=CNC3=CC=C2)C(=O)C(=O)O

InChI

InChI=1S/C20H16N2O4/c1-3-12(11-16-17(26-2)8-10-22-16)18(19(23)20(24)25)14-5-4-6-15-13(14)7-9-21-15/h1,4-11,18,21-22H,2H3,(H,24,25)/b12-11+