propan-2-yl (Z)-7-[(1R,2R,3R,5S)-2-[(E,3S)-5-(5-cyanothiophen-2-yl)-3-oxidanyl-pent-1-enyl]-3,5-bis(oxidanyl)cyclopentyl]hept-5-enoate

Systemtic Name: propan-2-yl (Z)-7-[(1R,2R,3R,5S)-2-[(E,3S)-5-(5-cyanothiophen-2-yl)-3-oxidanyl-pent-1-enyl]-3,5-bis(oxidanyl)cyclopentyl]hept-5-enoate Openeye Name: isopropyl (Z)-7-[(1R,2R,3R,5S)-2-[(E,3S)-5-(5-cyano-2-thienyl)-3-hydroxy-pent-1-enyl]-3,5-dihydroxy-cyclopentyl]hept-5-enoate CAS Name: (Z)-7-[(1R,2R,3R,5S)-2-[(E,3S)-5-(5-cyano-2-thiophenyl)-3-hydroxypent-1-enyl]-3,5-dihydroxycyclopentyl]-5-heptenoic acid propan-2-yl ester IUPAC Name: propan-2-yl (Z)-7-[(1R,2R,3R,5S)-2-[(E,3S)-5-(5-cyanothiophen-2-yl)-3-hydroxypent-1-enyl]-3,5-dihydroxycyclopentyl]hept-5-enoate Traditional Name: (Z)-7-[(1R,2R,3R,5S)-2-[(E,3S)-5-(5-cyano-2-thienyl)-3-hydroxy-pent-1-enyl]-3,5-dihydroxy-cyclopentyl]hept-5-enoic acid isopropyl ester Formula: C25H35NO5S MolecularWeight: 461.6141

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CCCC=CCC1C(CC(C1C=CC(CCC2=CC=C(S2)C#N)O)O)O

Isomeric SMILES

CC(C)OC(=O)CCC/C=C\C[C@H]1[C@H](C[C@H]([C@@H]1/C=C/[C@H](CCC2=CC=C(S2)C#N)O)O)O

InChI

InChI=1S/C25H35NO5S/c1-17(2)31-25(30)8-6-4-3-5-7-21-22(24(29)15-23(21)28)14-10-18(27)9-11-19-12-13-20(16-26)32-19/h3,5,10,12-14,17-18,21-24,27-29H,4,6-9,11,15H2,1-2H3/b5-3-,14-10+/t18-,21+,22+,23-,24+/m0/s1