9H-fluoren-9-ylmethyl N-[(2S)-1-isothiocyanato-3-methyl-butan-2-yl]carbamate

Systemtic Name: 9H-fluoren-9-ylmethyl N-[(2S)-1-isothiocyanato-3-methyl-butan-2-yl]carbamate Openeye Name: 9H-fluoren-9-ylmethyl N-[(1S)-1-(isothiocyanatomethyl)-2-methyl-propyl]carbamate CAS Name: N-[(2S)-1-isothiocyanato-3-methylbutan-2-yl]carbamic acid 9H-fluoren-9-ylmethyl ester IUPAC Name: 9H-fluoren-9-ylmethyl N-[(2S)-1-isothiocyanato-3-methylbutan-2-yl]carbamate Traditional Name: N-[(1S)-1-(isothiocyanatomethyl)-2-methyl-propyl]carbamic acid 9H-fluoren-9-ylmethyl ester Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CN=C=S)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13

Isomeric SMILES

CC(C)[C@@H](CN=C=S)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13

InChI

InChI=1S/C21H22N2O2S/c1-14(2)20(11-22-13-26)23-21(24)25-12-19-17-9-5-3-7-15(17)16-8-4-6-10-18(16)19/h3-10,14,19-20H,11-12H2,1-2H3,(H,23,24)/t20-/m1/s1