(1-butyl-1,2,3,4-tetrazol-5-yl)methyl (E)-3-(2-nitrophenyl)prop-2-enoate

Systemtic Name: (1-butyl-1,2,3,4-tetrazol-5-yl)methyl (E)-3-(2-nitrophenyl)prop-2-enoate Openeye Name: (1-butyltetrazol-5-yl)methyl (E)-3-(2-nitrophenyl)prop-2-enoate CAS Name: (E)-3-(2-nitrophenyl)-2-propenoic acid (1-butyl-5-tetrazolyl)methyl ester IUPAC Name: (1-butyltetrazol-5-yl)methyl (E)-3-(2-nitrophenyl)prop-2-enoate Traditional Name: (E)-3-(2-nitrophenyl)acrylic acid (1-butyltetrazol-5-yl)methyl ester Formula: C15H17N5O4 MolecularWeight: 331.32658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=N1)COC(=O)C=CC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C15H17N5O4/c1-2-3-10-19-14(16-17-18-19)11-24-15(21)9-8-12-6-4-5-7-13(12)20(22)23/h4-9H,2-3,10-11H2,1H3/b9-8+