7-[butyl(cyclohexyl)amino]-5-methyl-4-phenylazanyl-spiro[2-benzofuran-3,9'-xanthene]-1-one

Systemtic Name: 7-[butyl(cyclohexyl)amino]-5-methyl-4-phenylazanyl-spiro[2-benzofuran-3,9'-xanthene]-1-one Openeye Name: 4-anilino-7-[butyl(cyclohexyl)amino]-5-methyl-spiro[isobenzofuran-3,9'-xanthene]-1-one CAS Name: 4-anilino-7-[butyl(cyclohexyl)amino]-5-methyl-1-spiro[isobenzofuran-3,9'-xanthene]one IUPAC Name: 4-anilino-7-[butyl(cyclohexyl)amino]-5-methylspiro[2-benzofuran-3,9'-xanthene]-1-one Traditional Name: 4-anilino-7-[butyl(cyclohexyl)amino]-5-methyl-spiro[phthalan-3,9'-xanthene]-1-one Formula: C37H38N2O3 MolecularWeight: 558.70922

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1CCCCC1)C2=C3C(=C(C(=C2)C)NC4=CC=CC=C4)C5(C6=CC=CC=C6OC7=CC=CC=C75)OC3=O

Isomeric SMILES

CCCCN(C1CCCCC1)C2=C3C(=C(C(=C2)C)NC4=CC=CC=C4)C5(C6=CC=CC=C6OC7=CC=CC=C75)OC3=O

InChI

InChI=1S/C37H38N2O3/c1-3-4-23-39(27-17-9-6-10-18-27)30-24-25(2)35(38-26-15-7-5-8-16-26)34-33(30)36(40)42-37(34)28-19-11-13-21-31(28)41-32-22-14-12-20-29(32)37/h5,7-8,11-16,19-22,24,27,38H,3-4,6,9-10,17-18,23H2,1-2H3