1-(3-nitrophenyl)ethyl 3-methyl-6-thiophen-2-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxylate

Systemtic Name: 1-(3-nitrophenyl)ethyl 3-methyl-6-thiophen-2-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxylate Openeye Name: 1-(3-nitrophenyl)ethyl 3-methyl-6-(2-thienyl)isoxazolo[5,4-b]pyridine-4-carboxylate CAS Name: 3-methyl-6-thiophen-2-yl-4-isoxazolo[5,4-b]pyridinecarboxylic acid 1-(3-nitrophenyl)ethyl ester IUPAC Name: 1-(3-nitrophenyl)ethyl 3-methyl-6-thiophen-2-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxylate Traditional Name: 3-methyl-6-(2-thienyl)isoxazolo[5,4-b]pyridine-4-carboxylic acid 1-(3-nitrophenyl)ethyl ester Formula: C20H15N3O5S MolecularWeight: 409.4152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC2=C1C(=CC(=N2)C3=CC=CS3)C(=O)OC(C)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=NOC2=C1C(=CC(=N2)C3=CC=CS3)C(=O)OC(C)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H15N3O5S/c1-11-18-15(10-16(17-7-4-8-29-17)21-19(18)28-22-11)20(24)27-12(2)13-5-3-6-14(9-13)23(25)26/h3-10,12H,1-2H3