methyl 4-tert-butyl-3-[3-(2-methoxy-4-methyl-phenyl)octanoylamino]benzoate

Systemtic Name: methyl 4-tert-butyl-3-[3-(2-methoxy-4-methyl-phenyl)octanoylamino]benzoate Openeye Name: methyl 4-tert-butyl-3-[3-(2-methoxy-4-methyl-phenyl)octanoylamino]benzoate CAS Name: 4-tert-butyl-3-[[3-(2-methoxy-4-methylphenyl)-1-oxooctyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-tert-butyl-3-[3-(2-methoxy-4-methylphenyl)octanoylamino]benzoate Traditional Name: 4-tert-butyl-3-[3-(2-methoxy-4-methyl-phenyl)octanoylamino]benzoic acid methyl ester Formula: C28H39NO4 MolecularWeight: 453.61356

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H39NO4/c1-8-9-10-11-20(22-14-12-19(2)16-25(22)32-6)18-26(30)29-24-17-21(27(31)33-7)13-15-23(24)28(3,4)5/h12-17,20H,8-11,18H2,1-7H3,(H,29,30)