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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCC(C1)COC2=CC=C(C=C2)C(=O)C3=C(SC4=C3C=CC(=C4)O)C5=CC=C(C=C5)O

Isomeric SMILES

CCCN1CCC(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/c1-2-14-30-15-13-19(17-30)18-34-24-10-5-20(6-11-24)28(33)27-25-12-9-23(32)16-26(25)35-29(27)21-3-7-22(31)8-4-21/h3-12,16,19,31-32H,2,13-15,17-18H2,1H3