2-[(2-fluorophenyl)methyl-(2-phenylethanoyl)amino]-N-(4-methoxyphenyl)-2-methyl-butanamide

Systemtic Name: 2-[(2-fluorophenyl)methyl-(2-phenylethanoyl)amino]-N-(4-methoxyphenyl)-2-methyl-butanamide Openeye Name: 2-[(2-fluorophenyl)methyl-(2-phenylacetyl)amino]-N-(4-methoxyphenyl)-2-methyl-butanamide CAS Name: 2-[(2-fluorophenyl)methyl-(1-oxo-2-phenylethyl)amino]-N-(4-methoxyphenyl)-2-methylbutanamide IUPAC Name: 2-[(2-fluorophenyl)methyl-(2-phenylacetyl)amino]-N-(4-methoxyphenyl)-2-methylbutanamide Traditional Name: 2-[(2-fluorobenzyl)-(2-phenylacetyl)amino]-N-(4-methoxyphenyl)-2-methyl-butyramide Formula: C27H29FN2O3 MolecularWeight: 448.529163

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C(=O)NC1=CC=C(C=C1)OC)N(CC2=CC=CC=C2F)C(=O)CC3=CC=CC=C3

Isomeric SMILES

CCC(C)(C(=O)NC1=CC=C(C=C1)OC)N(CC2=CC=CC=C2F)C(=O)CC3=CC=CC=C3

InChI

InChI=1S/C27H29FN2O3/c1-4-27(2,26(32)29-22-14-16-23(33-3)17-15-22)30(19-21-12-8-9-13-24(21)28)25(31)18-20-10-6-5-7-11-20/h5-17H,4,18-19H2,1-3H3,(H,29,32)