ethyl 3-[(E)-3-oxidanylidenebut-1-enyl]-2-phenyl-indole-1-carboxylate

Systemtic Name: ethyl 3-[(E)-3-oxidanylidenebut-1-enyl]-2-phenyl-indole-1-carboxylate Openeye Name: ethyl 3-[(E)-3-oxobut-1-enyl]-2-phenyl-indole-1-carboxylate CAS Name: 3-[(E)-3-oxobut-1-enyl]-2-phenyl-1-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(E)-3-oxobut-1-enyl]-2-phenylindole-1-carboxylate Traditional Name: 3-[(E)-3-ketobut-1-enyl]-2-phenyl-indole-1-carboxylic acid ethyl ester Formula: C21H19NO3 MolecularWeight: 333.38046

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C2=CC=CC=C2C(=C1C3=CC=CC=C3)C=CC(=O)C

Isomeric SMILES

CCOC(=O)N1C2=CC=CC=C2C(=C1C3=CC=CC=C3)/C=C/C(=O)C

InChI

InChI=1S/C21H19NO3/c1-3-25-21(24)22-19-12-8-7-11-17(19)18(14-13-15(2)23)20(22)16-9-5-4-6-10-16/h4-14H,3H2,1-2H3/b14-13+