ethyl 3-[2-(2-methoxy-5-nitro-phenoxy)ethanoylamino]-5-phenyl-thiophene-2-carboxylate

Systemtic Name: ethyl 3-[2-(2-methoxy-5-nitro-phenoxy)ethanoylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: ethyl 3-[[2-(2-methoxy-5-nitro-phenoxy)acetyl]amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[2-(2-methoxy-5-nitrophenoxy)-1-oxoethyl]amino]-5-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-(2-methoxy-5-nitrophenoxy)acetyl]amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[[2-(2-methoxy-5-nitro-phenoxy)acetyl]amino]-5-phenyl-thiophene-2-carboxylic acid ethyl ester Formula: C22H20N2O7S MolecularWeight: 456.4684

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)COC3=C(C=CC(=C3)[N+](=O)[O-])OC

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)COC3=C(C=CC(=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C22H20N2O7S/c1-3-30-22(26)21-16(12-19(32-21)14-7-5-4-6-8-14)23-20(25)13-31-18-11-15(24(27)28)9-10-17(18)29-2/h4-12H,3,13H2,1-2H3,(H,23,25)