O2-tert-butyl O4-ethyl 3-methyl-5-(9H-xanthen-9-ylcarbonylamino)thiophene-2,4-dicarboxylate

Systemtic Name: O2-tert-butyl O4-ethyl 3-methyl-5-(9H-xanthen-9-ylcarbonylamino)thiophene-2,4-dicarboxylate Openeye Name: O2-tert-butyl O4-ethyl 3-methyl-5-(9H-xanthene-9-carbonylamino)thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[oxo(9H-xanthen-9-yl)methyl]amino]thiophene-2,4-dicarboxylic acid O2-tert-butyl ester O4-ethyl ester IUPAC Name: 2-O-tert-butyl 4-O-ethyl 3-methyl-5-(9H-xanthene-9-carbonylamino)thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-(9H-xanthene-9-carbonylamino)thiophene-2,4-dicarboxylic acid O2-tert-butyl ester O4-ethyl ester Formula: C27H27NO6S MolecularWeight: 493.57138

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OC(C)(C)C)NC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OC(C)(C)C)NC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24

InChI

InChI=1S/C27H27NO6S/c1-6-32-25(30)20-15(2)22(26(31)34-27(3,4)5)35-24(20)28-23(29)21-16-11-7-9-13-18(16)33-19-14-10-8-12-17(19)21/h7-14,21H,6H2,1-5H3,(H,28,29)