methyl 4-hexyl-2-phenyl-5-[(E)-2-phenylethenyl]-1-(phenylsulfonyl)pyrrole-3-carboxylate

Systemtic Name: methyl 4-hexyl-2-phenyl-5-[(E)-2-phenylethenyl]-1-(phenylsulfonyl)pyrrole-3-carboxylate Openeye Name: methyl 1-(benzenesulfonyl)-4-hexyl-2-phenyl-5-[(E)-styryl]pyrrole-3-carboxylate CAS Name: 1-(benzenesulfonyl)-4-hexyl-2-phenyl-5-[(E)-2-phenylethenyl]-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-(benzenesulfonyl)-4-hexyl-2-phenyl-5-[(E)-2-phenylethenyl]pyrrole-3-carboxylate Traditional Name: 1-besyl-4-hexyl-2-phenyl-5-[(E)-styryl]pyrrole-3-carboxylic acid methyl ester Formula: C32H33NO4S MolecularWeight: 527.67372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(N(C(=C1C(=O)OC)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)C=CC4=CC=CC=C4

Isomeric SMILES

CCCCCCC1=C(N(C(=C1C(=O)OC)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C32H33NO4S/c1-3-4-5-15-22-28-29(24-23-25-16-9-6-10-17-25)33(38(35,36)27-20-13-8-14-21-27)31(30(28)32(34)37-2)26-18-11-7-12-19-26/h6-14,16-21,23-24H,3-5,15,22H2,1-2H3/b24-23+