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

Systemtic Name: (1-butyl-1,2,3,4-tetrazol-5-yl)methyl 5-(4-nitrophenyl)furan-2-carboxylate Openeye Name: (1-butyltetrazol-5-yl)methyl 5-(4-nitrophenyl)furan-2-carboxylate CAS Name: 5-(4-nitrophenyl)-2-furancarboxylic acid (1-butyl-5-tetrazolyl)methyl ester IUPAC Name: (1-butyltetrazol-5-yl)methyl 5-(4-nitrophenyl)furan-2-carboxylate Traditional Name: 5-(4-nitrophenyl)furan-2-carboxylic acid (1-butyltetrazol-5-yl)methyl ester Formula: C17H17N5O5 MolecularWeight: 371.34738

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=N1)COC(=O)C2=CC=C(O2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCN1C(=NN=N1)COC(=O)C2=CC=C(O2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O5/c1-2-3-10-21-16(18-19-20-21)11-26-17(23)15-9-8-14(27-15)12-4-6-13(7-5-12)22(24)25/h4-9H,2-3,10-11H2,1H3