1-[2-(2,4-dimethylphenoxy)ethyl]benzotriazole; ethanedioic acid

Systemtic Name: 1-[2-(2,4-dimethylphenoxy)ethyl]benzotriazole; ethanedioic acid Openeye Name: 1-[2-(2,4-dimethylphenoxy)ethyl]benzotriazole; oxalic acid CAS Name: 1-[2-(2,4-dimethylphenoxy)ethyl]benzotriazole; oxalic acid IUPAC Name: 1-[2-(2,4-dimethylphenoxy)ethyl]benzotriazole; oxalic acid Traditional Name: 1-[2-(2,4-dimethylphenoxy)ethyl]benzotriazole; oxalic acid Formula: C18H19N3O5 MolecularWeight: 357.36056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCN2C3=CC=CC=C3N=N2)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=C(C=C1)OCCN2C3=CC=CC=C3N=N2)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H17N3O.C2H2O4/c1-12-7-8-16(13(2)11-12)20-10-9-19-15-6-4-3-5-14(15)17-18-19;3-1(4)2(5)6/h3-8,11H,9-10H2,1-2H3;(H,3,4)(H,5,6)