N-[3-(benzotriazol-1-yl)propyl]-5-(phenoxymethyl)-1,2-oxazole-3-carboxamide

Systemtic Name: N-[3-(benzotriazol-1-yl)propyl]-5-(phenoxymethyl)-1,2-oxazole-3-carboxamide Openeye Name: N-[3-(benzotriazol-1-yl)propyl]-5-(phenoxymethyl)isoxazole-3-carboxamide CAS Name: N-[3-(1-benzotriazolyl)propyl]-5-(phenoxymethyl)-3-isoxazolecarboxamide IUPAC Name: N-[3-(benzotriazol-1-yl)propyl]-5-(phenoxymethyl)-1,2-oxazole-3-carboxamide Traditional Name: N-[3-(benzotriazol-1-yl)propyl]-5-(phenoxymethyl)isoxazole-3-carboxamide Formula: C20H19N5O3 MolecularWeight: 377.39656

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC2=CC(=NO2)C(=O)NCCCN3C4=CC=CC=C4N=N3

Isomeric SMILES

C1=CC=C(C=C1)OCC2=CC(=NO2)C(=O)NCCCN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C20H19N5O3/c26-20(18-13-16(28-23-18)14-27-15-7-2-1-3-8-15)21-11-6-12-25-19-10-5-4-9-17(19)22-24-25/h1-5,7-10,13H,6,11-12,14H2,(H,21,26)