4-chloranyl-5-methyl-7-(3-methylpiperidin-1-yl)spiro[2-benzofuran-3,9'-xanthene]-1-one

Systemtic Name: 4-chloranyl-5-methyl-7-(3-methylpiperidin-1-yl)spiro[2-benzofuran-3,9'-xanthene]-1-one Openeye Name: 4-chloro-5-methyl-7-(3-methyl-1-piperidyl)spiro[isobenzofuran-3,9'-xanthene]-1-one CAS Name: 4-chloro-5-methyl-7-(3-methyl-1-piperidinyl)-1-spiro[isobenzofuran-3,9'-xanthene]one IUPAC Name: 4-chloro-5-methyl-7-(3-methylpiperidin-1-yl)spiro[2-benzofuran-3,9'-xanthene]-1-one Traditional Name: 4-chloro-5-methyl-7-(3-methylpiperidino)spiro[phthalan-3,9'-xanthene]-1-one Formula: C27H24ClNO3 MolecularWeight: 445.93736

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C3C(=C(C(=C2)C)Cl)C4(C5=CC=CC=C5OC6=CC=CC=C64)OC3=O

Isomeric SMILES

CC1CCCN(C1)C2=C3C(=C(C(=C2)C)Cl)C4(C5=CC=CC=C5OC6=CC=CC=C64)OC3=O

InChI

InChI=1S/C27H24ClNO3/c1-16-8-7-13-29(15-16)20-14-17(2)25(28)24-23(20)26(30)32-27(24)18-9-3-5-11-21(18)31-22-12-6-4-10-19(22)27/h3-6,9-12,14,16H,7-8,13,15H2,1-2H3