2-(5-ethylsulfonyl-2-methoxy-phenyl)-1-[(E)-2-methyloct-6-enyl]pyrrole

Systemtic Name: 2-(5-ethylsulfonyl-2-methoxy-phenyl)-1-[(E)-2-methyloct-6-enyl]pyrrole Openeye Name: 2-(5-ethylsulfonyl-2-methoxy-phenyl)-1-[(E)-2-methyloct-6-enyl]pyrrole CAS Name: 2-(5-ethylsulfonyl-2-methoxyphenyl)-1-[(E)-2-methyloct-6-enyl]pyrrole IUPAC Name: 2-(5-ethylsulfonyl-2-methoxyphenyl)-1-[(E)-2-methyloct-6-enyl]pyrrole Traditional Name: 2-(5-esyl-2-methoxy-phenyl)-1-[(E)-2-methyloct-6-enyl]pyrrole Formula: C22H31NO3S MolecularWeight: 389.55144

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC(=C(C=C1)OC)C2=CC=CN2CC(C)CCCC=CC

Isomeric SMILES

CCS(=O)(=O)C1=CC(=C(C=C1)OC)C2=CC=CN2CC(C)CCC/C=C/C

InChI

InChI=1S/C22H31NO3S/c1-5-7-8-9-11-18(3)17-23-15-10-12-21(23)20-16-19(27(24,25)6-2)13-14-22(20)26-4/h5,7,10,12-16,18H,6,8-9,11,17H2,1-4H3/b7-5+