5-methyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]-3-phenyl-1,2-oxazole-4-carboxamide

Systemtic Name: 5-methyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]-3-phenyl-1,2-oxazole-4-carboxamide Openeye Name: 5-methyl-N-[3-(2-oxoazepan-1-yl)propyl]-3-phenyl-isoxazole-4-carboxamide CAS Name: 5-methyl-N-[3-(2-oxo-1-azepanyl)propyl]-3-phenyl-4-isoxazolecarboxamide IUPAC Name: 5-methyl-N-[3-(2-oxoazepan-1-yl)propyl]-3-phenyl-1,2-oxazole-4-carboxamide Traditional Name: N-[3-(2-ketoazepan-1-yl)propyl]-5-methyl-3-phenyl-isoxazole-4-carboxamide Formula: C20H25N3O3 MolecularWeight: 355.4308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NCCCN3CCCCCC3=O

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NCCCN3CCCCCC3=O

InChI

InChI=1S/C20H25N3O3/c1-15-18(19(22-26-15)16-9-4-2-5-10-16)20(25)21-12-8-14-23-13-7-3-6-11-17(23)24/h2,4-5,9-10H,3,6-8,11-14H2,1H3,(H,21,25)