dimethyl 9-methoxy-2-methyl-8-oxidanyl-1-thiophen-2-yl-1H-2-benzazocine-4,5-dicarboxylate

Systemtic Name: dimethyl 9-methoxy-2-methyl-8-oxidanyl-1-thiophen-2-yl-1H-2-benzazocine-4,5-dicarboxylate Openeye Name: dimethyl 8-hydroxy-9-methoxy-2-methyl-1-(2-thienyl)-1H-2-benzazocine-4,5-dicarboxylate CAS Name: 8-hydroxy-9-methoxy-2-methyl-1-thiophen-2-yl-1H-2-benzazocine-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 8-hydroxy-9-methoxy-2-methyl-1-thiophen-2-yl-1H-2-benzazocine-4,5-dicarboxylate Traditional Name: 8-hydroxy-9-methoxy-2-methyl-1-(2-thienyl)-1H-2-benzazocine-4,5-dicarboxylic acid dimethyl ester Formula: C21H21NO6S MolecularWeight: 415.45954

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=CC2=CC(=C(C=C2C1C3=CC=CS3)OC)O)C(=O)OC)C(=O)OC

Isomeric SMILES

CN1C=C(C(=CC2=CC(=C(C=C2C1C3=CC=CS3)OC)O)C(=O)OC)C(=O)OC

InChI

InChI=1S/C21H21NO6S/c1-22-11-15(21(25)28-4)14(20(24)27-3)8-12-9-16(23)17(26-2)10-13(12)19(22)18-6-5-7-29-18/h5-11,19,23H,1-4H3