(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 4-[(2-nitrophenyl)amino]butanoate

Systemtic Name: (2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 4-[(2-nitrophenyl)amino]butanoate Openeye Name: [2-(2-thienyl)oxazol-4-yl]methyl 4-(2-nitroanilino)butanoate CAS Name: 4-(2-nitroanilino)butanoic acid (2-thiophen-2-yl-4-oxazolyl)methyl ester IUPAC Name: (2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 4-(2-nitroanilino)butanoate Traditional Name: 4-(2-nitroanilino)butyric acid [2-(2-thienyl)oxazol-4-yl]methyl ester Formula: C18H17N3O5S MolecularWeight: 387.40968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NCCCC(=O)OCC2=COC(=N2)C3=CC=CS3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)NCCCC(=O)OCC2=COC(=N2)C3=CC=CS3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O5S/c22-17(8-3-9-19-14-5-1-2-6-15(14)21(23)24)25-11-13-12-26-18(20-13)16-7-4-10-27-16/h1-2,4-7,10,12,19H,3,8-9,11H2