2-(benzotriazol-1-ylmethyl)-4-dodecyl-phenolate

Systemtic Name: 2-(benzotriazol-1-ylmethyl)-4-dodecyl-phenolate Openeye Name: 2-(benzotriazol-1-ylmethyl)-4-dodecyl-phenolate CAS Name: 2-(1-benzotriazolylmethyl)-4-dodecylphenolate IUPAC Name: 2-(benzotriazol-1-ylmethyl)-4-dodecylphenolate Traditional Name: 2-(benzotriazol-1-ylmethyl)-4-lauryl-phenolate Formula: C25H34N3O- MolecularWeight: 392.55696

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC(=C(C=C1)[O-])CN2C3=CC=CC=C3N=N2

Isomeric SMILES

CCCCCCCCCCCCC1=CC(=C(C=C1)[O-])CN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C25H35N3O/c1-2-3-4-5-6-7-8-9-10-11-14-21-17-18-25(29)22(19-21)20-28-24-16-13-12-15-23(24)26-27-28/h12-13,15-19,29H,2-11,14,20H2,1H3/p-1