(E)-7-[4-[(5-oxidanyl-1-benzothiophen-3-yl)carbonylamino]-3-bicyclo[3.1.1]heptanyl]hept-5-enoic acid

Systemtic Name: (E)-7-[4-[(5-oxidanyl-1-benzothiophen-3-yl)carbonylamino]-3-bicyclo[3.1.1]heptanyl]hept-5-enoic acid Openeye Name: (E)-7-[2-[(5-hydroxybenzothiophene-3-carbonyl)amino]norpinan-3-yl]hept-5-enoic acid CAS Name: (E)-7-[4-[[(5-hydroxy-1-benzothiophen-3-yl)-oxomethyl]amino]-3-bicyclo[3.1.1]heptanyl]-5-heptenoic acid IUPAC Name: (E)-7-[4-[(5-hydroxy-1-benzothiophene-3-carbonyl)amino]-3-bicyclo[3.1.1]heptanyl]hept-5-enoic acid Traditional Name: (E)-7-[2-[(5-hydroxybenzothiophene-3-carbonyl)amino]norpinan-3-yl]hept-5-enoic acid Formula: C23H27NO4S MolecularWeight: 413.52978

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC1C(C(C2)CC=CCCCC(=O)O)NC(=O)C3=CSC4=C3C=C(C=C4)O

Isomeric SMILES

C1C2CC1C(C(C2)C/C=C/CCCC(=O)O)NC(=O)C3=CSC4=C3C=C(C=C4)O

InChI

InChI=1S/C23H27NO4S/c25-17-7-8-20-18(12-17)19(13-29-20)23(28)24-22-15(9-14-10-16(22)11-14)5-3-1-2-4-6-21(26)27/h1,3,7-8,12-16,22,25H,2,4-6,9-11H2,(H,24,28)(H,26,27)/b3-1+