1-(2-ethylheptyl)-2-(5-ethylsulfonyl-2-methoxy-phenyl)pyrrole

Systemtic Name: 1-(2-ethylheptyl)-2-(5-ethylsulfonyl-2-methoxy-phenyl)pyrrole Openeye Name: 1-(2-ethylheptyl)-2-(5-ethylsulfonyl-2-methoxy-phenyl)pyrrole CAS Name: 1-(2-ethylheptyl)-2-(5-ethylsulfonyl-2-methoxyphenyl)pyrrole IUPAC Name: 1-(2-ethylheptyl)-2-(5-ethylsulfonyl-2-methoxyphenyl)pyrrole Traditional Name: 2-(5-esyl-2-methoxy-phenyl)-1-(2-ethylheptyl)pyrrole Formula: C22H33NO3S MolecularWeight: 391.56732

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)CN1C=CC=C1C2=C(C=CC(=C2)S(=O)(=O)CC)OC

Isomeric SMILES

CCCCCC(CC)CN1C=CC=C1C2=C(C=CC(=C2)S(=O)(=O)CC)OC

InChI

InChI=1S/C22H33NO3S/c1-5-8-9-11-18(6-2)17-23-15-10-12-21(23)20-16-19(27(24,25)7-3)13-14-22(20)26-4/h10,12-16,18H,5-9,11,17H2,1-4H3