2-[(4-cyanophenyl)amino]-2-[3-(methoxymethyl)-4-propan-2-yloxy-phenyl]ethanoic acid

Systemtic Name: 2-[(4-cyanophenyl)amino]-2-[3-(methoxymethyl)-4-propan-2-yloxy-phenyl]ethanoic acid Openeye Name: 2-(4-cyanoanilino)-2-[4-isopropoxy-3-(methoxymethyl)phenyl]acetic acid CAS Name: 2-(4-cyanoanilino)-2-[3-(methoxymethyl)-4-propan-2-yloxyphenyl]acetic acid IUPAC Name: 2-(4-cyanoanilino)-2-[3-(methoxymethyl)-4-propan-2-yloxyphenyl]acetic acid Traditional Name: 2-(4-cyanoanilino)-2-[4-isopropoxy-3-(methoxymethyl)phenyl]acetic acid Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C(C(=O)O)NC2=CC=C(C=C2)C#N)COC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C(C(=O)O)NC2=CC=C(C=C2)C#N)COC

InChI

InChI=1S/C20H22N2O4/c1-13(2)26-18-9-6-15(10-16(18)12-25-3)19(20(23)24)22-17-7-4-14(11-21)5-8-17/h4-10,13,19,22H,12H2,1-3H3,(H,23,24)