diethylamino (E)-7-[5-[4-(1-benzothiophen-2-yl)-3-oxidanyl-butyl]-3,3-dimethyl-4-oxidanyl-2-oxidanylidene-cyclopentyl]hept-5-enoate

Systemtic Name: diethylamino (E)-7-[5-[4-(1-benzothiophen-2-yl)-3-oxidanyl-butyl]-3,3-dimethyl-4-oxidanyl-2-oxidanylidene-cyclopentyl]hept-5-enoate Openeye Name: diethylamino (E)-7-[5-[4-(benzothiophen-2-yl)-3-hydroxy-butyl]-4-hydroxy-3,3-dimethyl-2-oxo-cyclopentyl]hept-5-enoate CAS Name: (E)-7-[5-[4-(1-benzothiophen-2-yl)-3-hydroxybutyl]-4-hydroxy-3,3-dimethyl-2-oxocyclopentyl]-5-heptenoic acid diethylamino ester IUPAC Name: diethylamino (E)-7-[5-[4-(1-benzothiophen-2-yl)-3-hydroxybutyl]-4-hydroxy-3,3-dimethyl-2-oxocyclopentyl]hept-5-enoate Traditional Name: (E)-7-[5-[4-(benzothiophen-2-yl)-3-hydroxy-butyl]-4-hydroxy-2-keto-3,3-dimethyl-cyclopentyl]hept-5-enoic acid diethylamino ester Formula: C30H43NO5S MolecularWeight: 529.73112

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)OC(=O)CCCC=CCC1C(C(C(C1=O)(C)C)O)CCC(CC2=CC3=CC=CC=C3S2)O

Isomeric SMILES

CCN(CC)OC(=O)CCC/C=C/CC1C(C(C(C1=O)(C)C)O)CCC(CC2=CC3=CC=CC=C3S2)O

InChI

InChI=1S/C30H43NO5S/c1-5-31(6-2)36-27(33)16-10-8-7-9-14-24-25(29(35)30(3,4)28(24)34)18-17-22(32)20-23-19-21-13-11-12-15-26(21)37-23/h7,9,11-13,15,19,22,24-25,29,32,35H,5-6,8,10,14,16-18,20H2,1-4H3/b9-7+