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

Systemtic Name: (1-butyl-1,2,3,4-tetrazol-5-yl)methyl 4-oxidanylidenechromene-2-carboxylate Openeye Name: (1-butyltetrazol-5-yl)methyl 4-oxochromene-2-carboxylate CAS Name: 4-oxo-1-benzopyran-2-carboxylic acid (1-butyl-5-tetrazolyl)methyl ester IUPAC Name: (1-butyltetrazol-5-yl)methyl 4-oxochromene-2-carboxylate Traditional Name: 4-ketochromene-2-carboxylic acid (1-butyltetrazol-5-yl)methyl ester Formula: C16H16N4O4 MolecularWeight: 328.32264

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=N1)COC(=O)C2=CC(=O)C3=CC=CC=C3O2

Isomeric SMILES

CCCCN1C(=NN=N1)COC(=O)C2=CC(=O)C3=CC=CC=C3O2

InChI

InChI=1S/C16H16N4O4/c1-2-3-8-20-15(17-18-19-20)10-23-16(22)14-9-12(21)11-6-4-5-7-13(11)24-14/h4-7,9H,2-3,8,10H2,1H3