N-(4-methoxy-2-nitro-phenyl)-4-[(2,3,5-trimethylphenoxy)methyl]thiophene-2-carboxamide

Systemtic Name: N-(4-methoxy-2-nitro-phenyl)-4-[(2,3,5-trimethylphenoxy)methyl]thiophene-2-carboxamide Openeye Name: N-(4-methoxy-2-nitro-phenyl)-4-[(2,3,5-trimethylphenoxy)methyl]thiophene-2-carboxamide CAS Name: N-(4-methoxy-2-nitrophenyl)-4-[(2,3,5-trimethylphenoxy)methyl]-2-thiophenecarboxamide IUPAC Name: N-(4-methoxy-2-nitrophenyl)-4-[(2,3,5-trimethylphenoxy)methyl]thiophene-2-carboxamide Traditional Name: N-(4-methoxy-2-nitro-phenyl)-4-[(2,3,5-trimethylphenoxy)methyl]thiophene-2-carboxamide Formula: C22H22N2O5S MolecularWeight: 426.48548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OCC2=CSC(=C2)C(=O)NC3=C(C=C(C=C3)OC)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OCC2=CSC(=C2)C(=O)NC3=C(C=C(C=C3)OC)[N+](=O)[O-])C)C

InChI

InChI=1S/C22H22N2O5S/c1-13-7-14(2)15(3)20(8-13)29-11-16-9-21(30-12-16)22(25)23-18-6-5-17(28-4)10-19(18)24(26)27/h5-10,12H,11H2,1-4H3,(H,23,25)