(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 4-azanyl-3-nitro-benzoate

Systemtic Name: (2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 4-azanyl-3-nitro-benzoate Openeye Name: [2-(2-thienyl)oxazol-4-yl]methyl 4-amino-3-nitro-benzoate CAS Name: 4-amino-3-nitrobenzoic acid (2-thiophen-2-yl-4-oxazolyl)methyl ester IUPAC Name: (2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 4-amino-3-nitrobenzoate Traditional Name: 4-amino-3-nitro-benzoic acid [2-(2-thienyl)oxazol-4-yl]methyl ester Formula: C15H11N3O5S MolecularWeight: 345.32994

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NC(=CO2)COC(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-]

Isomeric SMILES

C1=CSC(=C1)C2=NC(=CO2)COC(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-]

InChI

InChI=1S/C15H11N3O5S/c16-11-4-3-9(6-12(11)18(20)21)15(19)23-8-10-7-22-14(17-10)13-2-1-5-24-13/h1-7H,8,16H2