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

Systemtic Name: N-[3-(2-oxidanylideneazepan-1-yl)propyl]-3-phenyl-1,2-oxazole-5-carboxamide Openeye Name: N-[3-(2-oxoazepan-1-yl)propyl]-3-phenyl-isoxazole-5-carboxamide CAS Name: N-[3-(2-oxo-1-azepanyl)propyl]-3-phenyl-5-isoxazolecarboxamide IUPAC Name: N-[3-(2-oxoazepan-1-yl)propyl]-3-phenyl-1,2-oxazole-5-carboxamide Traditional Name: N-[3-(2-ketoazepan-1-yl)propyl]-3-phenyl-isoxazole-5-carboxamide Formula: C19H23N3O3 MolecularWeight: 341.40422

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CCCNC(=O)C2=CC(=NO2)C3=CC=CC=C3

Isomeric SMILES

C1CCC(=O)N(CC1)CCCNC(=O)C2=CC(=NO2)C3=CC=CC=C3

InChI

InChI=1S/C19H23N3O3/c23-18-10-5-2-6-12-22(18)13-7-11-20-19(24)17-14-16(21-25-17)15-8-3-1-4-9-15/h1,3-4,8-9,14H,2,5-7,10-13H2,(H,20,24)