methyl (E)-2-[5-[(E)-8-acetyloxyoct-6-enyl]-1-(4-methylphenyl)sulfonyl-pyrrol-2-yl]carbonyl-4-methyl-pent-2-enoate

Systemtic Name: methyl (E)-2-[5-[(E)-8-acetyloxyoct-6-enyl]-1-(4-methylphenyl)sulfonyl-pyrrol-2-yl]carbonyl-4-methyl-pent-2-enoate Openeye Name: methyl (E)-2-[5-[(E)-8-acetoxyoct-6-enyl]-1-(p-tolylsulfonyl)pyrrole-2-carbonyl]-4-methyl-pent-2-enoate CAS Name: (E)-2-[[5-[(E)-8-acetyloxyoct-6-enyl]-1-(4-methylphenyl)sulfonyl-2-pyrrolyl]-oxomethyl]-4-methyl-2-pentenoic acid methyl ester IUPAC Name: methyl (E)-2-[5-[(E)-8-acetyloxyoct-6-enyl]-1-(4-methylphenyl)sulfonylpyrrole-2-carbonyl]-4-methylpent-2-enoate Traditional Name: (E)-2-[5-[(E)-8-acetoxyoct-6-enyl]-1-tosyl-pyrrole-2-carbonyl]-4-methyl-pent-2-enoic acid methyl ester Formula: C29H37NO7S MolecularWeight: 543.67158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(=CC=C2C(=O)C(=CC(C)C)C(=O)OC)CCCCCC=CCOC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(=CC=C2C(=O)/C(=C\C(C)C)/C(=O)OC)CCCCC/C=C/COC(=O)C

InChI

InChI=1S/C29H37NO7S/c1-21(2)20-26(29(33)36-5)28(32)27-18-15-24(12-10-8-6-7-9-11-19-37-23(4)31)30(27)38(34,35)25-16-13-22(3)14-17-25/h9,11,13-18,20-21H,6-8,10,12,19H2,1-5H3/b11-9+,26-20+