4-(9H-fluoren-9-ylmethoxycarbonylamino)thiane-4-carboxylate

Systemtic Name: 4-(9H-fluoren-9-ylmethoxycarbonylamino)thiane-4-carboxylate Openeye Name: 4-(9H-fluoren-9-ylmethoxycarbonylamino)tetrahydrothiopyran-4-carboxylate CAS Name: 4-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-4-thianecarboxylate IUPAC Name: 4-(9H-fluoren-9-ylmethoxycarbonylamino)thiane-4-carboxylate Traditional Name: 4-(9H-fluoren-9-ylmethoxycarbonylamino)tetrahydrothiopyran-4-carboxylate Formula: C21H20NO4S- MolecularWeight: 382.4528

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCC1(C(=O)[O-])NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

Isomeric SMILES

C1CSCCC1(C(=O)[O-])NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

InChI

InChI=1S/C21H21NO4S/c23-19(24)21(9-11-27-12-10-21)22-20(25)26-13-18-16-7-3-1-5-14(16)15-6-2-4-8-17(15)18/h1-8,18H,9-13H2,(H,22,25)(H,23,24)/p-1