(2-phenylcyclohexyl) N-(1,3a,4,5,6,6a-hexahydropentalen-1-ylsulfinyl)carbamate

Systemtic Name: (2-phenylcyclohexyl) N-(1,3a,4,5,6,6a-hexahydropentalen-1-ylsulfinyl)carbamate Openeye Name: (2-phenylcyclohexyl) N-(1,3a,4,5,6,6a-hexahydropentalen-1-ylsulfinyl)carbamate CAS Name: N-(1,3a,4,5,6,6a-hexahydropentalen-1-ylsulfinyl)carbamic acid (2-phenylcyclohexyl) ester IUPAC Name: (2-phenylcyclohexyl) N-(1,3a,4,5,6,6a-hexahydropentalen-1-ylsulfinyl)carbamate Traditional Name: N-(1,3a,4,5,6,6a-hexahydropentalen-1-ylsulfinyl)carbamic acid (2-phenylcyclohexyl) ester Formula: C21H27NO3S MolecularWeight: 373.50898

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C2=CC=CC=C2)OC(=O)NS(=O)C3C=CC4C3CCC4

Isomeric SMILES

C1CCC(C(C1)C2=CC=CC=C2)OC(=O)NS(=O)C3C=CC4C3CCC4

InChI

InChI=1S/C21H27NO3S/c23-21(22-26(24)20-14-13-16-9-6-11-18(16)20)25-19-12-5-4-10-17(19)15-7-2-1-3-8-15/h1-3,7-8,13-14,16-20H,4-6,9-12H2,(H,22,23)