propan-2-yl 2-[5-bromanyl-1-[(4-methylphenyl)methyl]-2-oxidanylidene-3H-indol-3-yl]-2-cyano-ethanoate

Systemtic Name: propan-2-yl 2-[5-bromanyl-1-[(4-methylphenyl)methyl]-2-oxidanylidene-3H-indol-3-yl]-2-cyano-ethanoate Openeye Name: isopropyl 2-[5-bromo-2-oxo-1-(p-tolylmethyl)indolin-3-yl]-2-cyano-acetate CAS Name: 2-[5-bromo-1-[(4-methylphenyl)methyl]-2-oxo-3H-indol-3-yl]-2-cyanoacetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[5-bromo-1-[(4-methylphenyl)methyl]-2-oxo-3H-indol-3-yl]-2-cyanoacetate Traditional Name: 2-[5-bromo-2-keto-1-(4-methylbenzyl)indolin-3-yl]-2-cyano-acetic acid isopropyl ester Formula: C22H21BrN2O3 MolecularWeight: 441.31774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C3=C(C=C(C=C3)Br)C(C2=O)C(C#N)C(=O)OC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C3=C(C=C(C=C3)Br)C(C2=O)C(C#N)C(=O)OC(C)C

InChI

InChI=1S/C22H21BrN2O3/c1-13(2)28-22(27)18(11-24)20-17-10-16(23)8-9-19(17)25(21(20)26)12-15-6-4-14(3)5-7-15/h4-10,13,18,20H,12H2,1-3H3