dimethyl 5-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-ylcarbonylamino)benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-ylcarbonylamino)benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonylamino)benzene-1,3-dicarboxylate CAS Name: 5-[[oxo(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)methyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonylamino)benzene-1,3-dicarboxylate Traditional Name: 5-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonylamino)benzene-1,3-dicarboxylic acid dimethyl ester Formula: C20H21NO5S MolecularWeight: 387.44944

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)C2=CC3=C(S2)CCCCC3)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)C2=CC3=C(S2)CCCCC3)C(=O)OC

InChI

InChI=1S/C20H21NO5S/c1-25-19(23)13-8-14(20(24)26-2)10-15(9-13)21-18(22)17-11-12-6-4-3-5-7-16(12)27-17/h8-11H,3-7H2,1-2H3,(H,21,22)