2-[4-[3-oxidanylidene-3-(phenethylamino)-2-(phenethylcarbamoyl)prop-1-enyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[3-oxidanylidene-3-(phenethylamino)-2-(phenethylcarbamoyl)prop-1-enyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[3-oxo-3-(phenethylamino)-2-(phenethylcarbamoyl)prop-1-enyl]phenoxy]acetic acid CAS Name: 2-[4-[3-oxo-2-[oxo-(phenethylamino)methyl]-3-(phenethylamino)prop-1-enyl]phenoxy]acetic acid IUPAC Name: 2-[4-[3-oxo-3-(phenethylamino)-2-(phenethylcarbamoyl)prop-1-enyl]phenoxy]acetic acid Traditional Name: 2-[4-[3-keto-3-(phenethylamino)-2-(phenethylcarbamoyl)prop-1-enyl]phenoxy]acetic acid Formula: C28H28N2O5 MolecularWeight: 472.53232

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C(=CC2=CC=C(C=C2)OCC(=O)O)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)C(=CC2=CC=C(C=C2)OCC(=O)O)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C28H28N2O5/c31-26(32)20-35-24-13-11-23(12-14-24)19-25(27(33)29-17-15-21-7-3-1-4-8-21)28(34)30-18-16-22-9-5-2-6-10-22/h1-14,19H,15-18,20H2,(H,29,33)(H,30,34)(H,31,32)