sodium 5-[(3Z)-3-[(3-methoxy-1H-pyrrol-2-yl)methylidene]-2-oxidanylidene-1H-indol-4-yl]pent-4-ynoate

Systemtic Name: sodium 5-[(3Z)-3-[(3-methoxy-1H-pyrrol-2-yl)methylidene]-2-oxidanylidene-1H-indol-4-yl]pent-4-ynoate Openeye Name: sodium 5-[(3Z)-3-[(3-methoxy-1H-pyrrol-2-yl)methylene]-2-oxo-indolin-4-yl]pent-4-ynoate CAS Name: sodium 5-[(3Z)-3-[(3-methoxy-1H-pyrrol-2-yl)methylidene]-2-oxo-1H-indol-4-yl]-4-pentynoate IUPAC Name: sodium 5-[(3Z)-3-[(3-methoxy-1H-pyrrol-2-yl)methylidene]-2-oxo-1H-indol-4-yl]pent-4-ynoate Traditional Name: sodium 5-[(3Z)-2-keto-3-[(3-methoxy-1H-pyrrol-2-yl)methylene]indolin-4-yl]pent-4-ynoate Formula: C19H15N2NaO4 MolecularWeight: 358.32317

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(NC=C1)C=C2C3=C(C=CC=C3NC2=O)C#CCCC(=O)[O-].[Na+]

Isomeric SMILES

COC1=C(NC=C1)/C=C\2/C3=C(C=CC=C3NC2=O)C#CCCC(=O)[O-].[Na+]

InChI

InChI=1S/C19H16N2O4.Na/c1-25-16-9-10-20-15(16)11-13-18-12(5-2-3-8-17(22)23)6-4-7-14(18)21-19(13)24;/h4,6-7,9-11,20H,3,8H2,1H3,(H,21,24)(H,22,23);/q;+1/p-1/b13-11-;