1'-[4-(5-methyl-1-benzothiophen-3-yl)butyl]spiro[1H-2-benzofuran-3,4'-piperidine]

Systemtic Name: 1'-[4-(5-methyl-1-benzothiophen-3-yl)butyl]spiro[1H-2-benzofuran-3,4'-piperidine] Openeye Name: 1'-[4-(5-methylbenzothiophen-3-yl)butyl]spiro[1H-isobenzofuran-3,4'-piperidine] CAS Name: 1'-[4-(5-methyl-1-benzothiophen-3-yl)butyl]spiro[1H-isobenzofuran-3,4'-piperidine] IUPAC Name: 1'-[4-(5-methyl-1-benzothiophen-3-yl)butyl]spiro[1H-2-benzofuran-3,4'-piperidine] Traditional Name: 1'-[4-(5-methylbenzothiophen-3-yl)butyl]spiro[phthalan-1,4'-piperidine] Formula: C25H29NOS MolecularWeight: 391.56886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC=C2CCCCN3CCC4(CC3)C5=CC=CC=C5CO4

Isomeric SMILES

CC1=CC2=C(C=C1)SC=C2CCCCN3CCC4(CC3)C5=CC=CC=C5CO4

InChI

InChI=1S/C25H29NOS/c1-19-9-10-24-22(16-19)21(18-28-24)7-4-5-13-26-14-11-25(12-15-26)23-8-3-2-6-20(23)17-27-25/h2-3,6,8-10,16,18H,4-5,7,11-15,17H2,1H3