propan-2-yl 1-(4-chlorophenyl)sulfonylcycloheptane-1-carboxylate

Systemtic Name: propan-2-yl 1-(4-chlorophenyl)sulfonylcycloheptane-1-carboxylate Openeye Name: isopropyl 1-(4-chlorophenyl)sulfonylcycloheptanecarboxylate CAS Name: 1-(4-chlorophenyl)sulfonyl-1-cycloheptanecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 1-(4-chlorophenyl)sulfonylcycloheptane-1-carboxylate Traditional Name: 1-(4-chlorophenyl)sulfonylcycloheptanecarboxylic acid isopropyl ester Formula: C17H23ClO4S MolecularWeight: 358.88012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1(CCCCCC1)S(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)OC(=O)C1(CCCCCC1)S(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H23ClO4S/c1-13(2)22-16(19)17(11-5-3-4-6-12-17)23(20,21)15-9-7-14(18)8-10-15/h7-10,13H,3-6,11-12H2,1-2H3