4-[2-[methyl(phenethyl)amino]-2-oxidanylidene-ethyl]-8-phenoxy-naphthalene-2-carboxylic acid

Systemtic Name: 4-[2-[methyl(phenethyl)amino]-2-oxidanylidene-ethyl]-8-phenoxy-naphthalene-2-carboxylic acid Openeye Name: 4-[2-[methyl(phenethyl)amino]-2-oxo-ethyl]-8-phenoxy-naphthalene-2-carboxylic acid CAS Name: 4-[2-[methyl(phenethyl)amino]-2-oxoethyl]-8-phenoxy-2-naphthalenecarboxylic acid IUPAC Name: 4-[2-[methyl(phenethyl)amino]-2-oxoethyl]-8-phenoxynaphthalene-2-carboxylic acid Traditional Name: 4-[2-keto-2-[methyl(phenethyl)amino]ethyl]-8-phenoxy-2-naphthoic acid Formula: C28H25NO4 MolecularWeight: 439.5024

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=C1)C(=O)CC2=C3C=CC=C(C3=CC(=C2)C(=O)O)OC4=CC=CC=C4

Isomeric SMILES

CN(CCC1=CC=CC=C1)C(=O)CC2=C3C=CC=C(C3=CC(=C2)C(=O)O)OC4=CC=CC=C4

InChI

InChI=1S/C28H25NO4/c1-29(16-15-20-9-4-2-5-10-20)27(30)19-21-17-22(28(31)32)18-25-24(21)13-8-14-26(25)33-23-11-6-3-7-12-23/h2-14,17-18H,15-16,19H2,1H3,(H,31,32)