[4-[(1-ethylpiperidin-3-yl)methoxy]phenyl]-[2-(4-hydroxyphenyl)-6-oxidanyl-1-benzothiophen-3-yl]methanone

Systemtic Name: [4-[(1-ethylpiperidin-3-yl)methoxy]phenyl]-[2-(4-hydroxyphenyl)-6-oxidanyl-1-benzothiophen-3-yl]methanone Openeye Name: [4-[(1-ethyl-3-piperidyl)methoxy]phenyl]-[6-hydroxy-2-(4-hydroxyphenyl)benzothiophen-3-yl]methanone CAS Name: [4-[(1-ethyl-3-piperidinyl)methoxy]phenyl]-[6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]methanone IUPAC Name: [4-[(1-ethylpiperidin-3-yl)methoxy]phenyl]-[6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]methanone Traditional Name: [4-[(1-ethyl-3-piperidyl)methoxy]phenyl]-[6-hydroxy-2-(4-hydroxyphenyl)benzothiophen-3-yl]methanone Formula: C29H29NO4S MolecularWeight: 487.60986

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC(C1)COC2=CC=C(C=C2)C(=O)C3=C(SC4=C3C=CC(=C4)O)C5=CC=C(C=C5)O

Isomeric SMILES

CCN1CCCC(C1)COC2=CC=C(C=C2)C(=O)C3=C(SC4=C3C=CC(=C4)O)C5=CC=C(C=C5)O

InChI

InChI=1S/C29H29NO4S/c1-2-30-15-3-4-19(17-30)18-34-24-12-7-20(8-13-24)28(33)27-25-14-11-23(32)16-26(25)35-29(27)21-5-9-22(31)10-6-21/h5-14,16,19,31-32H,2-4,15,17-18H2,1H3