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

Systemtic Name: 3-[4-[(2-cycloheptyl-6-oxidanyl-1-benzothiophen-3-yl)carbonyl]phenyl]-1-piperidin-1-yl-propan-1-one Openeye Name: 3-[4-(2-cycloheptyl-6-hydroxy-benzothiophene-3-carbonyl)phenyl]-1-(1-piperidyl)propan-1-one CAS Name: 3-[4-[(2-cycloheptyl-6-hydroxy-1-benzothiophen-3-yl)-oxomethyl]phenyl]-1-(1-piperidinyl)-1-propanone IUPAC Name: 3-[4-(2-cycloheptyl-6-hydroxy-1-benzothiophene-3-carbonyl)phenyl]-1-piperidin-1-ylpropan-1-one Traditional Name: 3-[4-(2-cycloheptyl-6-hydroxy-benzothiophene-3-carbonyl)phenyl]-1-piperidino-propan-1-one Formula: C30H35NO3S MolecularWeight: 489.6688

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)C2=C(C3=C(S2)C=C(C=C3)O)C(=O)C4=CC=C(C=C4)CCC(=O)N5CCCCC5

Isomeric SMILES

C1CCCC(CC1)C2=C(C3=C(S2)C=C(C=C3)O)C(=O)C4=CC=C(C=C4)CCC(=O)N5CCCCC5

InChI

InChI=1S/C30H35NO3S/c32-24-15-16-25-26(20-24)35-30(23-8-4-1-2-5-9-23)28(25)29(34)22-13-10-21(11-14-22)12-17-27(33)31-18-6-3-7-19-31/h10-11,13-16,20,23,32H,1-9,12,17-19H2