2-(5-ethylsulfonyl-2-methoxy-phenyl)-1-heptan-3-yl-pyrrole

Systemtic Name: 2-(5-ethylsulfonyl-2-methoxy-phenyl)-1-heptan-3-yl-pyrrole Openeye Name: 1-(1-ethylpentyl)-2-(5-ethylsulfonyl-2-methoxy-phenyl)pyrrole CAS Name: 2-(5-ethylsulfonyl-2-methoxyphenyl)-1-heptan-3-ylpyrrole IUPAC Name: 2-(5-ethylsulfonyl-2-methoxyphenyl)-1-heptan-3-ylpyrrole Traditional Name: 2-(5-esyl-2-methoxy-phenyl)-1-(1-ethylpentyl)pyrrole Formula: C20H29NO3S MolecularWeight: 363.51416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)N1C=CC=C1C2=C(C=CC(=C2)S(=O)(=O)CC)OC

Isomeric SMILES

CCCCC(CC)N1C=CC=C1C2=C(C=CC(=C2)S(=O)(=O)CC)OC

InChI

InChI=1S/C20H29NO3S/c1-5-8-10-16(6-2)21-14-9-11-19(21)18-15-17(25(22,23)7-3)12-13-20(18)24-4/h9,11-16H,5-8,10H2,1-4H3