2-[(4-cyanophenyl)amino]-2-[3-ethoxy-5-(2-methylpropoxy)phenyl]ethanoic acid

Systemtic Name: 2-[(4-cyanophenyl)amino]-2-[3-ethoxy-5-(2-methylpropoxy)phenyl]ethanoic acid Openeye Name: 2-(4-cyanoanilino)-2-(3-ethoxy-5-isobutoxy-phenyl)acetic acid CAS Name: 2-(4-cyanoanilino)-2-[3-ethoxy-5-(2-methylpropoxy)phenyl]acetic acid IUPAC Name: 2-(4-cyanoanilino)-2-[3-ethoxy-5-(2-methylpropoxy)phenyl]acetic acid Traditional Name: 2-(4-cyanoanilino)-2-(3-ethoxy-5-isobutoxy-phenyl)acetic acid Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1)C(C(=O)O)NC2=CC=C(C=C2)C#N)OCC(C)C

Isomeric SMILES

CCOC1=CC(=CC(=C1)C(C(=O)O)NC2=CC=C(C=C2)C#N)OCC(C)C

InChI

InChI=1S/C21H24N2O4/c1-4-26-18-9-16(10-19(11-18)27-13-14(2)3)20(21(24)25)23-17-7-5-15(12-22)6-8-17/h5-11,14,20,23H,4,13H2,1-3H3,(H,24,25)