4-phenylazanyl-7-(3-propylhexylamino)spiro[2-benzofuran-3,9'-xanthene]-1-one

Systemtic Name: 4-phenylazanyl-7-(3-propylhexylamino)spiro[2-benzofuran-3,9'-xanthene]-1-one Openeye Name: 4-anilino-7-(3-propylhexylamino)spiro[isobenzofuran-3,9'-xanthene]-1-one CAS Name: 4-anilino-7-(3-propylhexylamino)-1-spiro[isobenzofuran-3,9'-xanthene]one IUPAC Name: 4-anilino-7-(3-propylhexylamino)spiro[2-benzofuran-3,9'-xanthene]-1-one Traditional Name: 4-anilino-7-(3-propylhexylamino)spiro[phthalan-3,9'-xanthene]-1-one Formula: C35H36N2O3 MolecularWeight: 532.67194

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)CCNC1=C2C(=C(C=C1)NC3=CC=CC=C3)C4(C5=CC=CC=C5OC6=CC=CC=C64)OC2=O

Isomeric SMILES

CCCC(CCC)CCNC1=C2C(=C(C=C1)NC3=CC=CC=C3)C4(C5=CC=CC=C5OC6=CC=CC=C64)OC2=O

InChI

InChI=1S/C35H36N2O3/c1-3-12-24(13-4-2)22-23-36-28-20-21-29(37-25-14-6-5-7-15-25)33-32(28)34(38)40-35(33)26-16-8-10-18-30(26)39-31-19-11-9-17-27(31)35/h5-11,14-21,24,36-37H,3-4,12-13,22-23H2,1-2H3