N-[3-(benzotriazol-1-yl)propyl]-2-(2-methoxyethyl)-1,3-benzoxazole-6-carboxamide

Systemtic Name: N-[3-(benzotriazol-1-yl)propyl]-2-(2-methoxyethyl)-1,3-benzoxazole-6-carboxamide Openeye Name: N-[3-(benzotriazol-1-yl)propyl]-2-(2-methoxyethyl)-1,3-benzoxazole-6-carboxamide CAS Name: N-[3-(1-benzotriazolyl)propyl]-2-(2-methoxyethyl)-1,3-benzoxazole-6-carboxamide IUPAC Name: N-[3-(benzotriazol-1-yl)propyl]-2-(2-methoxyethyl)-1,3-benzoxazole-6-carboxamide Traditional Name: N-[3-(benzotriazol-1-yl)propyl]-2-(2-methoxyethyl)-1,3-benzoxazole-6-carboxamide Formula: C20H21N5O3 MolecularWeight: 379.41244

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Descriptors Computed from Structure

Canonical SMILES:

COCCC1=NC2=C(O1)C=C(C=C2)C(=O)NCCCN3C4=CC=CC=C4N=N3

Isomeric SMILES

COCCC1=NC2=C(O1)C=C(C=C2)C(=O)NCCCN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C20H21N5O3/c1-27-12-9-19-22-16-8-7-14(13-18(16)28-19)20(26)21-10-4-11-25-17-6-3-2-5-15(17)23-24-25/h2-3,5-8,13H,4,9-12H2,1H3,(H,21,26)