dimethyl 5-azanyl-3-[(3-methyl-4-nitro-phenoxy)methyl]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-azanyl-3-[(3-methyl-4-nitro-phenoxy)methyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[(3-methyl-4-nitro-phenoxy)methyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[(3-methyl-4-nitrophenoxy)methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[(3-methyl-4-nitrophenoxy)methyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[(3-methyl-4-nitro-phenoxy)methyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C16H16N2O7S MolecularWeight: 380.37244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=C(SC(=C2C(=O)OC)N)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=C(SC(=C2C(=O)OC)N)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O7S/c1-8-6-9(4-5-11(8)18(21)22)25-7-10-12(15(19)23-2)14(17)26-13(10)16(20)24-3/h4-6H,7,17H2,1-3H3