1-chloranyl-2-[(1R,2E)-1-isocyanato-2-(3-phenylmethoxypropylidene)cyclohexyl]benzene

Systemtic Name: 1-chloranyl-2-[(1R,2E)-1-isocyanato-2-(3-phenylmethoxypropylidene)cyclohexyl]benzene Openeye Name: 1-[(1R,2E)-2-(3-benzyloxypropylidene)-1-isocyanato-cyclohexyl]-2-chloro-benzene CAS Name: 1-chloro-2-[(1R,2E)-1-isocyanato-2-(3-phenylmethoxypropylidene)cyclohexyl]benzene IUPAC Name: 1-chloro-2-[(1R,2E)-1-isocyanato-2-(3-phenylmethoxypropylidene)cyclohexyl]benzene Traditional Name: 1-[(1R,2E)-2-(3-benzoxypropylidene)-1-isocyanato-cyclohexyl]-2-chloro-benzene Formula: C23H24ClNO2 MolecularWeight: 381.89516

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(=CCCOCC2=CC=CC=C2)C1)(C3=CC=CC=C3Cl)N=C=O

Isomeric SMILES

C1CC[C@@](/C(=C/CCOCC2=CC=CC=C2)/C1)(C3=CC=CC=C3Cl)N=C=O

InChI

InChI=1S/C23H24ClNO2/c24-22-14-5-4-13-21(22)23(25-18-26)15-7-6-11-20(23)12-8-16-27-17-19-9-2-1-3-10-19/h1-5,9-10,12-14H,6-8,11,15-17H2/b20-12+/t23-/m1/s1