N-[4-(4-spiro[1H-2-benzofuran-3,4'-cyclohexane]-1'-ylpiperazin-1-yl)phenyl]ethanamide

Systemtic Name: N-[4-(4-spiro[1H-2-benzofuran-3,4'-cyclohexane]-1'-ylpiperazin-1-yl)phenyl]ethanamide Openeye Name: N-[4-(4-spiro[1H-isobenzofuran-3,4'-cyclohexane]-1'-ylpiperazin-1-yl)phenyl]acetamide CAS Name: N-[4-[4-(1'-spiro[1H-isobenzofuran-3,4'-cyclohexane]yl)-1-piperazinyl]phenyl]acetamide IUPAC Name: N-[4-(4-spiro[1H-2-benzofuran-3,4'-cyclohexane]-1'-ylpiperazin-1-yl)phenyl]acetamide Traditional Name: N-[4-(4-spiro[cyclohexane-4,1'-phthalan]-1-ylpiperazino)phenyl]acetamide Formula: C25H31N3O2 MolecularWeight: 405.53254

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)N2CCN(CC2)C3CCC4(CC3)C5=CC=CC=C5CO4

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)N2CCN(CC2)C3CCC4(CC3)C5=CC=CC=C5CO4

InChI

InChI=1S/C25H31N3O2/c1-19(29)26-21-6-8-22(9-7-21)27-14-16-28(17-15-27)23-10-12-25(13-11-23)24-5-3-2-4-20(24)18-30-25/h2-9,23H,10-18H2,1H3,(H,26,29)