N-[2-[(2-fluorophenyl)carbamoyl-(4-phenoxyphenyl)amino]ethyl]-3,3-dimethyl-butanamide

Systemtic Name: N-[2-[(2-fluorophenyl)carbamoyl-(4-phenoxyphenyl)amino]ethyl]-3,3-dimethyl-butanamide Openeye Name: N-[2-[N-[(2-fluorophenyl)carbamoyl]-4-phenoxy-anilino]ethyl]-3,3-dimethyl-butanamide CAS Name: N-[2-(N-[(2-fluoroanilino)-oxomethyl]-4-phenoxyanilino)ethyl]-3,3-dimethylbutanamide IUPAC Name: N-[2-[N-[(2-fluorophenyl)carbamoyl]-4-phenoxyanilino]ethyl]-3,3-dimethylbutanamide Traditional Name: N-[2-[N-[(2-fluorophenyl)carbamoyl]-4-phenoxy-anilino]ethyl]-3,3-dimethyl-butyramide Formula: C27H30FN3O3 MolecularWeight: 463.543803

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)NCCN(C1=CC=C(C=C1)OC2=CC=CC=C2)C(=O)NC3=CC=CC=C3F

Isomeric SMILES

CC(C)(C)CC(=O)NCCN(C1=CC=C(C=C1)OC2=CC=CC=C2)C(=O)NC3=CC=CC=C3F

InChI

InChI=1S/C27H30FN3O3/c1-27(2,3)19-25(32)29-17-18-31(26(33)30-24-12-8-7-11-23(24)28)20-13-15-22(16-14-20)34-21-9-5-4-6-10-21/h4-16H,17-19H2,1-3H3,(H,29,32)(H,30,33)