2-[2-[methyl(phenethyl)amino]-2-oxidanylidene-ethyl]-4-phenylmethoxy-benzoic acid

Systemtic Name: 2-[2-[methyl(phenethyl)amino]-2-oxidanylidene-ethyl]-4-phenylmethoxy-benzoic acid Openeye Name: 4-benzyloxy-2-[2-[methyl(phenethyl)amino]-2-oxo-ethyl]benzoic acid CAS Name: 2-[2-[methyl(phenethyl)amino]-2-oxoethyl]-4-phenylmethoxybenzoic acid IUPAC Name: 2-[2-[methyl(phenethyl)amino]-2-oxoethyl]-4-phenylmethoxybenzoic acid Traditional Name: 4-benzoxy-2-[2-keto-2-[methyl(phenethyl)amino]ethyl]benzoic acid Formula: C25H25NO4 MolecularWeight: 403.4703

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=C1)C(=O)CC2=C(C=CC(=C2)OCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CN(CCC1=CC=CC=C1)C(=O)CC2=C(C=CC(=C2)OCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C25H25NO4/c1-26(15-14-19-8-4-2-5-9-19)24(27)17-21-16-22(12-13-23(21)25(28)29)30-18-20-10-6-3-7-11-20/h2-13,16H,14-15,17-18H2,1H3,(H,28,29)