methyl (3Z)-3-[(2-butoxyphenyl)methylidene]-2-oxidanylidene-1H-indole-6-carboxylate

Systemtic Name: methyl (3Z)-3-[(2-butoxyphenyl)methylidene]-2-oxidanylidene-1H-indole-6-carboxylate Openeye Name: methyl (3Z)-3-[(2-butoxyphenyl)methylene]-2-oxo-indoline-6-carboxylate CAS Name: (3Z)-3-[(2-butoxyphenyl)methylidene]-2-oxo-1H-indole-6-carboxylic acid methyl ester IUPAC Name: methyl (3Z)-3-[(2-butoxyphenyl)methylidene]-2-oxo-1H-indole-6-carboxylate Traditional Name: (3Z)-3-(2-butoxybenzylidene)-2-keto-indoline-6-carboxylic acid methyl ester Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC=C1C=C2C3=C(C=C(C=C3)C(=O)OC)NC2=O

Isomeric SMILES

CCCCOC1=CC=CC=C1/C=C\2/C3=C(C=C(C=C3)C(=O)OC)NC2=O

InChI

InChI=1S/C21H21NO4/c1-3-4-11-26-19-8-6-5-7-14(19)12-17-16-10-9-15(21(24)25-2)13-18(16)22-20(17)23/h5-10,12-13H,3-4,11H2,1-2H3,(H,22,23)/b17-12-