9H-fluoren-9-ylmethyl (2S)-2-(isothiocyanatomethyl)pyrrolidine-1-carboxylate

Systemtic Name: 9H-fluoren-9-ylmethyl (2S)-2-(isothiocyanatomethyl)pyrrolidine-1-carboxylate Openeye Name: 9H-fluoren-9-ylmethyl (2S)-2-(isothiocyanatomethyl)pyrrolidine-1-carboxylate CAS Name: (2S)-2-(isothiocyanatomethyl)-1-pyrrolidinecarboxylic acid 9H-fluoren-9-ylmethyl ester IUPAC Name: 9H-fluoren-9-ylmethyl (2S)-2-(isothiocyanatomethyl)pyrrolidine-1-carboxylate Traditional Name: (2S)-2-(isothiocyanatomethyl)pyrrolidine-1-carboxylic acid 9H-fluoren-9-ylmethyl ester Formula: C21H20N2O2S MolecularWeight: 364.4607

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)CN=C=S

Isomeric SMILES

C1C[C@H](N(C1)C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)CN=C=S

InChI

InChI=1S/C21H20N2O2S/c24-21(23-11-5-6-15(23)12-22-14-26)25-13-20-18-9-3-1-7-16(18)17-8-2-4-10-19(17)20/h1-4,7-10,15,20H,5-6,11-13H2/t15-/m0/s1