3-[4-[(2-cyclopentyl-6-oxidanyl-1-benzothiophen-3-yl)carbonyl]phenoxy]-1-piperidin-1-yl-propan-1-one

Systemtic Name: 3-[4-[(2-cyclopentyl-6-oxidanyl-1-benzothiophen-3-yl)carbonyl]phenoxy]-1-piperidin-1-yl-propan-1-one Openeye Name: 3-[4-(2-cyclopentyl-6-hydroxy-benzothiophene-3-carbonyl)phenoxy]-1-(1-piperidyl)propan-1-one CAS Name: 3-[4-[(2-cyclopentyl-6-hydroxy-1-benzothiophen-3-yl)-oxomethyl]phenoxy]-1-(1-piperidinyl)-1-propanone IUPAC Name: 3-[4-(2-cyclopentyl-6-hydroxy-1-benzothiophene-3-carbonyl)phenoxy]-1-piperidin-1-ylpropan-1-one Traditional Name: 3-[4-(2-cyclopentyl-6-hydroxy-benzothiophene-3-carbonyl)phenoxy]-1-piperidino-propan-1-one Formula: C28H31NO4S MolecularWeight: 477.61504

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CCOC2=CC=C(C=C2)C(=O)C3=C(SC4=C3C=CC(=C4)O)C5CCCC5

Isomeric SMILES

C1CCN(CC1)C(=O)CCOC2=CC=C(C=C2)C(=O)C3=C(SC4=C3C=CC(=C4)O)C5CCCC5

InChI

InChI=1S/C28H31NO4S/c30-21-10-13-23-24(18-21)34-28(20-6-2-3-7-20)26(23)27(32)19-8-11-22(12-9-19)33-17-14-25(31)29-15-4-1-5-16-29/h8-13,18,20,30H,1-7,14-17H2