N-[3-azanyl-7-(3-methoxyphenyl)-2-oxidanylidene-5-phenyl-azepan-1-yl]-N-tert-butyl-ethanamide

Systemtic Name: N-[3-azanyl-7-(3-methoxyphenyl)-2-oxidanylidene-5-phenyl-azepan-1-yl]-N-tert-butyl-ethanamide Openeye Name: N-[3-amino-7-(3-methoxyphenyl)-2-oxo-5-phenyl-azepan-1-yl]-N-tert-butyl-acetamide CAS Name: N-[3-amino-7-(3-methoxyphenyl)-2-oxo-5-phenyl-1-azepanyl]-N-tert-butylacetamide IUPAC Name: N-[3-amino-7-(3-methoxyphenyl)-2-oxo-5-phenylazepan-1-yl]-N-tert-butylacetamide Traditional Name: N-[3-amino-2-keto-7-(3-methoxyphenyl)-5-phenyl-azepan-1-yl]-N-tert-butyl-acetamide Formula: C25H33N3O3 MolecularWeight: 423.54782

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C(C)(C)C)N1C(CC(CC(C1=O)N)C2=CC=CC=C2)C3=CC(=CC=C3)OC

Isomeric SMILES

CC(=O)N(C(C)(C)C)N1C(CC(CC(C1=O)N)C2=CC=CC=C2)C3=CC(=CC=C3)OC

InChI

InChI=1S/C25H33N3O3/c1-17(29)28(25(2,3)4)27-23(19-12-9-13-21(14-19)31-5)16-20(15-22(26)24(27)30)18-10-7-6-8-11-18/h6-14,20,22-23H,15-16,26H2,1-5H3