2-[2-[2-[methyl(phenethyl)amino]-2-oxidanylidene-ethoxy]-4-phenylmethoxy-phenyl]prop-2-enoic acid

Systemtic Name: 2-[2-[2-[methyl(phenethyl)amino]-2-oxidanylidene-ethoxy]-4-phenylmethoxy-phenyl]prop-2-enoic acid Openeye Name: 2-[4-benzyloxy-2-[2-[methyl(phenethyl)amino]-2-oxo-ethoxy]phenyl]prop-2-enoic acid CAS Name: 2-[2-[2-[methyl(phenethyl)amino]-2-oxoethoxy]-4-phenylmethoxyphenyl]-2-propenoic acid IUPAC Name: 2-[2-[2-[methyl(phenethyl)amino]-2-oxoethoxy]-4-phenylmethoxyphenyl]prop-2-enoic acid Traditional Name: 2-[4-benzoxy-2-[2-keto-2-[methyl(phenethyl)amino]ethoxy]phenyl]acrylic acid Formula: C27H27NO5 MolecularWeight: 445.50698

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=C1)C(=O)COC2=C(C=CC(=C2)OCC3=CC=CC=C3)C(=C)C(=O)O

Isomeric SMILES

CN(CCC1=CC=CC=C1)C(=O)COC2=C(C=CC(=C2)OCC3=CC=CC=C3)C(=C)C(=O)O

InChI

InChI=1S/C27H27NO5/c1-20(27(30)31)24-14-13-23(32-18-22-11-7-4-8-12-22)17-25(24)33-19-26(29)28(2)16-15-21-9-5-3-6-10-21/h3-14,17H,1,15-16,18-19H2,2H3,(H,30,31)