1-tert-butyl-4-[(2S)-2-isocyanato-2-phenyl-ethyl]benzene

Systemtic Name: 1-tert-butyl-4-[(2S)-2-isocyanato-2-phenyl-ethyl]benzene Openeye Name: 1-tert-butyl-4-[(2S)-2-isocyanato-2-phenyl-ethyl]benzene CAS Name: 1-tert-butyl-4-[(2S)-2-isocyanato-2-phenylethyl]benzene IUPAC Name: 1-tert-butyl-4-[(2S)-2-isocyanato-2-phenylethyl]benzene Traditional Name: 1-tert-butyl-4-[(2S)-2-isocyanato-2-phenyl-ethyl]benzene Formula: C19H21NO MolecularWeight: 279.37614

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CC(C2=CC=CC=C2)N=C=O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C[C@@H](C2=CC=CC=C2)N=C=O

InChI

InChI=1S/C19H21NO/c1-19(2,3)17-11-9-15(10-12-17)13-18(20-14-21)16-7-5-4-6-8-16/h4-12,18H,13H2,1-3H3/t18-/m0/s1