N-[benzotriazol-1-yl(pyridin-3-yl)methyl]-3,4,5-trimethoxy-benzamide

Systemtic Name: N-[benzotriazol-1-yl(pyridin-3-yl)methyl]-3,4,5-trimethoxy-benzamide Openeye Name: N-[benzotriazol-1-yl(3-pyridyl)methyl]-3,4,5-trimethoxy-benzamide CAS Name: N-[1-benzotriazolyl(3-pyridinyl)methyl]-3,4,5-trimethoxybenzamide IUPAC Name: N-[benzotriazol-1-yl(pyridin-3-yl)methyl]-3,4,5-trimethoxybenzamide Traditional Name: N-[benzotriazol-1-yl(3-pyridyl)methyl]-3,4,5-trimethoxy-benzamide Formula: C22H21N5O4 MolecularWeight: 419.43324

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NC(C2=CN=CC=C2)N3C4=CC=CC=C4N=N3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NC(C2=CN=CC=C2)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C22H21N5O4/c1-29-18-11-15(12-19(30-2)20(18)31-3)22(28)24-21(14-7-6-10-23-13-14)27-17-9-5-4-8-16(17)25-26-27/h4-13,21H,1-3H3,(H,24,28)