ethyl 4-[2-(3-cyano-2-methyl-indol-1-yl)ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-(3-cyano-2-methyl-indol-1-yl)ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-(3-cyano-2-methyl-indol-1-yl)acetyl]amino]benzoate CAS Name: 4-[[2-(3-cyano-2-methyl-1-indolyl)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(3-cyano-2-methylindol-1-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(3-cyano-2-methyl-indol-1-yl)acetyl]amino]benzoic acid ethyl ester Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C(=C(C3=CC=CC=C32)C#N)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C(=C(C3=CC=CC=C32)C#N)C

InChI

InChI=1S/C21H19N3O3/c1-3-27-21(26)15-8-10-16(11-9-15)23-20(25)13-24-14(2)18(12-22)17-6-4-5-7-19(17)24/h4-11H,3,13H2,1-2H3,(H,23,25)