N-[(1R,2R,4S)-2-chloranyl-4-phenylmethoxy-cyclohexyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(1R,2R,4S)-2-chloranyl-4-phenylmethoxy-cyclohexyl]-4-methyl-benzenesulfonamide Openeye Name: N-[(1R,2R,4S)-4-benzyloxy-2-chloro-cyclohexyl]-4-methyl-benzenesulfonamide CAS Name: N-[(1R,2R,4S)-2-chloro-4-phenylmethoxycyclohexyl]-4-methylbenzenesulfonamide IUPAC Name: N-[(1R,2R,4S)-2-chloro-4-phenylmethoxycyclohexyl]-4-methylbenzenesulfonamide Traditional Name: N-[(1R,2R,4S)-4-benzoxy-2-chloro-cyclohexyl]-4-methyl-benzenesulfonamide Formula: C20H24ClNO3S MolecularWeight: 393.92746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2CCC(CC2Cl)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H]2CC[C@@H](C[C@H]2Cl)OCC3=CC=CC=C3

InChI

InChI=1S/C20H24ClNO3S/c1-15-7-10-18(11-8-15)26(23,24)22-20-12-9-17(13-19(20)21)25-14-16-5-3-2-4-6-16/h2-8,10-11,17,19-20,22H,9,12-14H2,1H3/t17-,19+,20+/m0/s1