N-[benzotriazol-1-yl(oxidanyl)methyl]-3-(ethoxymethoxy)-4-nitro-benzamide

Systemtic Name: N-[benzotriazol-1-yl(oxidanyl)methyl]-3-(ethoxymethoxy)-4-nitro-benzamide Openeye Name: N-[benzotriazol-1-yl(hydroxy)methyl]-3-(ethoxymethoxy)-4-nitro-benzamide CAS Name: N-[1-benzotriazolyl(hydroxy)methyl]-3-(ethoxymethoxy)-4-nitrobenzamide IUPAC Name: N-[benzotriazol-1-yl(hydroxy)methyl]-3-(ethoxymethoxy)-4-nitrobenzamide Traditional Name: N-[benzotriazol-1-yl(hydroxy)methyl]-3-(ethoxymethoxy)-4-nitro-benzamide Formula: C17H17N5O6 MolecularWeight: 387.34678

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Descriptors Computed from Structure

Canonical SMILES:

CCOCOC1=C(C=CC(=C1)C(=O)NC(N2C3=CC=CC=C3N=N2)O)[N+](=O)[O-]

Isomeric SMILES

CCOCOC1=C(C=CC(=C1)C(=O)NC(N2C3=CC=CC=C3N=N2)O)[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O6/c1-2-27-10-28-15-9-11(7-8-14(15)22(25)26)16(23)18-17(24)21-13-6-4-3-5-12(13)19-20-21/h3-9,17,24H,2,10H2,1H3,(H,18,23)