(1-cyanoindolizin-2-yl)methyl 3-(1H-indol-3-yl)propanoate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 3-(1H-indol-3-yl)propanoate Openeye Name: (1-cyanoindolizin-2-yl)methyl 3-(1H-indol-3-yl)propanoate CAS Name: 3-(1H-indol-3-yl)propanoic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 3-(1H-indol-3-yl)propanoate Traditional Name: 3-(1H-indol-3-yl)propionic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C21H17N3O2 MolecularWeight: 343.37858

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CCC(=O)OCC3=CN4C=CC=CC4=C3C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CCC(=O)OCC3=CN4C=CC=CC4=C3C#N

InChI

InChI=1S/C21H17N3O2/c22-11-18-16(13-24-10-4-3-7-20(18)24)14-26-21(25)9-8-15-12-23-19-6-2-1-5-17(15)19/h1-7,10,12-13,23H,8-9,14H2