(1-butyl-1,2,3,4-tetrazol-5-yl)methyl 3-oxidanylnaphthalene-2-carboxylate

Systemtic Name: (1-butyl-1,2,3,4-tetrazol-5-yl)methyl 3-oxidanylnaphthalene-2-carboxylate Openeye Name: (1-butyltetrazol-5-yl)methyl 3-hydroxynaphthalene-2-carboxylate CAS Name: 3-hydroxy-2-naphthalenecarboxylic acid (1-butyl-5-tetrazolyl)methyl ester IUPAC Name: (1-butyltetrazol-5-yl)methyl 3-hydroxynaphthalene-2-carboxylate Traditional Name: 3-hydroxynaphthalene-2-carboxylic acid (1-butyltetrazol-5-yl)methyl ester Formula: C17H18N4O3 MolecularWeight: 326.34982

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=N1)COC(=O)C2=CC3=CC=CC=C3C=C2O

Isomeric SMILES

CCCCN1C(=NN=N1)COC(=O)C2=CC3=CC=CC=C3C=C2O

InChI

InChI=1S/C17H18N4O3/c1-2-3-8-21-16(18-19-20-21)11-24-17(23)14-9-12-6-4-5-7-13(12)10-15(14)22/h4-7,9-10,22H,2-3,8,11H2,1H3