3-[4-(dibutylamino)-2-oxidanyl-phenyl]-3-(2-methoxy-5-phenylazanyl-phenyl)-2-benzofuran-1-one

Systemtic Name: 3-[4-(dibutylamino)-2-oxidanyl-phenyl]-3-(2-methoxy-5-phenylazanyl-phenyl)-2-benzofuran-1-one Openeye Name: 3-(5-anilino-2-methoxy-phenyl)-3-[4-(dibutylamino)-2-hydroxy-phenyl]isobenzofuran-1-one CAS Name: 3-(5-anilino-2-methoxyphenyl)-3-[4-(dibutylamino)-2-hydroxyphenyl]-1-isobenzofuranone IUPAC Name: 3-(5-anilino-2-methoxyphenyl)-3-[4-(dibutylamino)-2-hydroxyphenyl]-2-benzofuran-1-one Traditional Name: 3-(5-anilino-2-methoxy-phenyl)-3-[4-(dibutylamino)-2-hydroxy-phenyl]phthalide Formula: C35H38N2O4 MolecularWeight: 550.68722

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C1=CC(=C(C=C1)C2(C3=CC=CC=C3C(=O)O2)C4=C(C=CC(=C4)NC5=CC=CC=C5)OC)O

Isomeric SMILES

CCCCN(CCCC)C1=CC(=C(C=C1)C2(C3=CC=CC=C3C(=O)O2)C4=C(C=CC(=C4)NC5=CC=CC=C5)OC)O

InChI

InChI=1S/C35H38N2O4/c1-4-6-21-37(22-7-5-2)27-18-19-30(32(38)24-27)35(29-16-12-11-15-28(29)34(39)41-35)31-23-26(17-20-33(31)40-3)36-25-13-9-8-10-14-25/h8-20,23-24,36,38H,4-7,21-22H2,1-3H3