[2-[1-(2-cyanoethyl)indol-3-yl]-2-oxidanylidene-ethyl] 2-(2-oxidanylidene-1,3-benzoxazol-3-yl)ethanoate

Systemtic Name: [2-[1-(2-cyanoethyl)indol-3-yl]-2-oxidanylidene-ethyl] 2-(2-oxidanylidene-1,3-benzoxazol-3-yl)ethanoate Openeye Name: [2-[1-(2-cyanoethyl)indol-3-yl]-2-oxo-ethyl] 2-(2-oxo-1,3-benzoxazol-3-yl)acetate CAS Name: 2-(2-oxo-1,3-benzoxazol-3-yl)acetic acid [2-[1-(2-cyanoethyl)-3-indolyl]-2-oxoethyl] ester IUPAC Name: [2-[1-(2-cyanoethyl)indol-3-yl]-2-oxoethyl] 2-(2-oxo-1,3-benzoxazol-3-yl)acetate Traditional Name: 2-(2-keto-1,3-benzoxazol-3-yl)acetic acid [2-[1-(2-cyanoethyl)indol-3-yl]-2-keto-ethyl] ester Formula: C22H17N3O5 MolecularWeight: 403.38748

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CCC#N)C(=O)COC(=O)CN3C4=CC=CC=C4OC3=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CCC#N)C(=O)COC(=O)CN3C4=CC=CC=C4OC3=O

InChI

InChI=1S/C22H17N3O5/c23-10-5-11-24-12-16(15-6-1-2-7-17(15)24)19(26)14-29-21(27)13-25-18-8-3-4-9-20(18)30-22(25)28/h1-4,6-9,12H,5,11,13-14H2