4-[1-[(5-aminocarbonyl-2-tert-butyl-phenyl)amino]-1-oxidanylidene-octan-3-yl]-3-methoxy-benzoic acid

Systemtic Name: 4-[1-[(5-aminocarbonyl-2-tert-butyl-phenyl)amino]-1-oxidanylidene-octan-3-yl]-3-methoxy-benzoic acid Openeye Name: 4-[1-[2-(2-tert-butyl-5-carbamoyl-anilino)-2-oxo-ethyl]hexyl]-3-methoxy-benzoic acid CAS Name: 4-[1-(2-tert-butyl-5-carbamoylanilino)-1-oxooctan-3-yl]-3-methoxybenzoic acid IUPAC Name: 4-[1-(2-tert-butyl-5-carbamoylanilino)-1-oxooctan-3-yl]-3-methoxybenzoic acid Traditional Name: 4-[1-[2-(2-tert-butyl-5-carbamoyl-anilino)-2-keto-ethyl]hexyl]-3-methoxy-benzoic acid Formula: C27H36N2O5 MolecularWeight: 468.58514

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC(=O)NC1=C(C=CC(=C1)C(=O)N)C(C)(C)C)C2=C(C=C(C=C2)C(=O)O)OC

Isomeric SMILES

CCCCCC(CC(=O)NC1=C(C=CC(=C1)C(=O)N)C(C)(C)C)C2=C(C=C(C=C2)C(=O)O)OC

InChI

InChI=1S/C27H36N2O5/c1-6-7-8-9-17(20-12-10-19(26(32)33)15-23(20)34-5)16-24(30)29-22-14-18(25(28)31)11-13-21(22)27(2,3)4/h10-15,17H,6-9,16H2,1-5H3,(H2,28,31)(H,29,30)(H,32,33)