6-[(4-methylphenyl)sulfonylmethyl]-N-phenyl-cycloheptene-1-carboxamide

Systemtic Name: 6-[(4-methylphenyl)sulfonylmethyl]-N-phenyl-cycloheptene-1-carboxamide Openeye Name: N-phenyl-6-(p-tolylsulfonylmethyl)cycloheptene-1-carboxamide CAS Name: 6-[(4-methylphenyl)sulfonylmethyl]-N-phenyl-1-cycloheptenecarboxamide IUPAC Name: 6-[(4-methylphenyl)sulfonylmethyl]-N-phenylcycloheptene-1-carboxamide Traditional Name: N-phenyl-6-(tosylmethyl)cycloheptene-1-carboxamide Formula: C22H25NO3S MolecularWeight: 383.5038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC2CCCC=C(C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC2CCCC=C(C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H25NO3S/c1-17-11-13-21(14-12-17)27(25,26)16-18-7-5-6-8-19(15-18)22(24)23-20-9-3-2-4-10-20/h2-4,8-14,18H,5-7,15-16H2,1H3,(H,23,24)