3-[2-cyanoethyl-[4-(4-ethoxyphenyl)carbonylphenyl]amino]propanenitrile

Systemtic Name: 3-[2-cyanoethyl-[4-(4-ethoxyphenyl)carbonylphenyl]amino]propanenitrile Openeye Name: 3-[N-(2-cyanoethyl)-4-(4-ethoxybenzoyl)anilino]propanenitrile CAS Name: 3-[N-(2-cyanoethyl)-4-[(4-ethoxyphenyl)-oxomethyl]anilino]propanenitrile IUPAC Name: 3-[N-(2-cyanoethyl)-4-(4-ethoxybenzoyl)anilino]propanenitrile Traditional Name: 3-[N-(2-cyanoethyl)-4-(4-ethoxybenzoyl)anilino]propionitrile Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)N(CCC#N)CCC#N

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)N(CCC#N)CCC#N

InChI

InChI=1S/C21H21N3O2/c1-2-26-20-11-7-18(8-12-20)21(25)17-5-9-19(10-6-17)24(15-3-13-22)16-4-14-23/h5-12H,2-4,15-16H2,1H3