2-[(4-ethylphenyl)carbonyl-propan-2-yl-amino]-5-phenoxy-benzoic acid

Systemtic Name: 2-[(4-ethylphenyl)carbonyl-propan-2-yl-amino]-5-phenoxy-benzoic acid Openeye Name: 2-[(4-ethylbenzoyl)-isopropyl-amino]-5-phenoxy-benzoic acid CAS Name: 2-[[(4-ethylphenyl)-oxomethyl]-propan-2-ylamino]-5-phenoxybenzoic acid IUPAC Name: 2-[(4-ethylbenzoyl)-propan-2-ylamino]-5-phenoxybenzoic acid Traditional Name: 2-[(4-ethylbenzoyl)-isopropyl-amino]-5-phenoxy-benzoic acid Formula: C25H25NO4 MolecularWeight: 403.4703

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N(C2=C(C=C(C=C2)OC3=CC=CC=C3)C(=O)O)C(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N(C2=C(C=C(C=C2)OC3=CC=CC=C3)C(=O)O)C(C)C

InChI

InChI=1S/C25H25NO4/c1-4-18-10-12-19(13-11-18)24(27)26(17(2)3)23-15-14-21(16-22(23)25(28)29)30-20-8-6-5-7-9-20/h5-17H,4H2,1-3H3,(H,28,29)