methyl 3-[(E)-3-oxidanylidenebut-1-enyl]-1H-indole-6-carboxylate

Systemtic Name: methyl 3-[(E)-3-oxidanylidenebut-1-enyl]-1H-indole-6-carboxylate Openeye Name: methyl 3-[(E)-3-oxobut-1-enyl]-1H-indole-6-carboxylate CAS Name: 3-[(E)-3-oxobut-1-enyl]-1H-indole-6-carboxylic acid methyl ester IUPAC Name: methyl 3-[(E)-3-oxobut-1-enyl]-1H-indole-6-carboxylate Traditional Name: 3-[(E)-3-ketobut-1-enyl]-1H-indole-6-carboxylic acid methyl ester Formula: C14H13NO3 MolecularWeight: 243.25792

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C=CC1=CNC2=C1C=CC(=C2)C(=O)OC

Isomeric SMILES

CC(=O)/C=C/C1=CNC2=C1C=CC(=C2)C(=O)OC

InChI

InChI=1S/C14H13NO3/c1-9(16)3-4-11-8-15-13-7-10(14(17)18-2)5-6-12(11)13/h3-8,15H,1-2H3/b4-3+