4'-(4-propan-2-ylpiperazin-1-yl)carbonylspiro[2-benzofuran-3,1'-cyclohexane]-1-one

Systemtic Name: 4'-(4-propan-2-ylpiperazin-1-yl)carbonylspiro[2-benzofuran-3,1'-cyclohexane]-1-one Openeye Name: 4-(4-isopropylpiperazine-1-carbonyl)spiro[cyclohexane-1,3'-isobenzofuran]-1'-one CAS Name: 4-[oxo-(4-propan-2-yl-1-piperazinyl)methyl]-1'-spiro[cyclohexane-1,3'-isobenzofuran]one IUPAC Name: 4'-(4-propan-2-ylpiperazine-1-carbonyl)spiro[2-benzofuran-3,1'-cyclohexane]-1-one Traditional Name: 4-(4-isopropylpiperazine-1-carbonyl)spiro[cyclohexane-1,3'-phthalan]-1'-one Formula: C21H28N2O3 MolecularWeight: 356.45862

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)C(=O)C2CCC3(CC2)C4=CC=CC=C4C(=O)O3

Isomeric SMILES

CC(C)N1CCN(CC1)C(=O)C2CCC3(CC2)C4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C21H28N2O3/c1-15(2)22-11-13-23(14-12-22)19(24)16-7-9-21(10-8-16)18-6-4-3-5-17(18)20(25)26-21/h3-6,15-16H,7-14H2,1-2H3