diethyl 2-[[(4-bromophenyl)amino]-(3,4-dimethylphenyl)methyl]propanedioate

Systemtic Name: diethyl 2-[[(4-bromophenyl)amino]-(3,4-dimethylphenyl)methyl]propanedioate Openeye Name: diethyl 2-[(4-bromoanilino)-(3,4-dimethylphenyl)methyl]propanedioate CAS Name: 2-[(4-bromoanilino)-(3,4-dimethylphenyl)methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(4-bromoanilino)-(3,4-dimethylphenyl)methyl]propanedioate Traditional Name: 2-[(4-bromoanilino)-(3,4-dimethylphenyl)methyl]malonic acid diethyl ester Formula: C22H26BrNO4 MolecularWeight: 448.35014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC(=C(C=C1)C)C)NC2=CC=C(C=C2)Br)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C(C1=CC(=C(C=C1)C)C)NC2=CC=C(C=C2)Br)C(=O)OCC

InChI

InChI=1S/C22H26BrNO4/c1-5-27-21(25)19(22(26)28-6-2)20(16-8-7-14(3)15(4)13-16)24-18-11-9-17(23)10-12-18/h7-13,19-20,24H,5-6H2,1-4H3