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

Systemtic Name: 7-[(3-ethyl-4-methyl-phenyl)amino]-5-methyl-4-phenylazanyl-spiro[2-benzofuran-3,9'-xanthene]-1-one Openeye Name: 4-anilino-7-(3-ethyl-4-methyl-anilino)-5-methyl-spiro[isobenzofuran-3,9'-xanthene]-1-one CAS Name: 4-anilino-7-(3-ethyl-4-methylanilino)-5-methyl-1-spiro[isobenzofuran-3,9'-xanthene]one IUPAC Name: 4-anilino-7-(3-ethyl-4-methylanilino)-5-methylspiro[2-benzofuran-3,9'-xanthene]-1-one Traditional Name: 4-anilino-7-(3-ethyl-4-methyl-anilino)-5-methyl-spiro[phthalan-3,9'-xanthene]-1-one Formula: C36H30N2O3 MolecularWeight: 538.635

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)NC2=C3C(=C(C(=C2)C)NC4=CC=CC=C4)C5(C6=CC=CC=C6OC7=CC=CC=C75)OC3=O)C

Isomeric SMILES

CCC1=C(C=CC(=C1)NC2=C3C(=C(C(=C2)C)NC4=CC=CC=C4)C5(C6=CC=CC=C6OC7=CC=CC=C75)OC3=O)C

InChI

InChI=1S/C36H30N2O3/c1-4-24-21-26(19-18-22(24)2)37-29-20-23(3)34(38-25-12-6-5-7-13-25)33-32(29)35(39)41-36(33)27-14-8-10-16-30(27)40-31-17-11-9-15-28(31)36/h5-21,37-38H,4H2,1-3H3