5-[(2-tert-butyl-5-methyl-phenyl)amino]-6-oxidanyl-2-phenethyl-2-phenyl-3H-pyran-4-one

Systemtic Name: 5-[(2-tert-butyl-5-methyl-phenyl)amino]-6-oxidanyl-2-phenethyl-2-phenyl-3H-pyran-4-one Openeye Name: 5-(2-tert-butyl-5-methyl-anilino)-6-hydroxy-2-phenethyl-2-phenyl-3H-pyran-4-one CAS Name: 5-(2-tert-butyl-5-methylanilino)-6-hydroxy-2-phenethyl-2-phenyl-3H-pyran-4-one IUPAC Name: 5-(2-tert-butyl-5-methylanilino)-6-hydroxy-2-phenethyl-2-phenyl-3H-pyran-4-one Traditional Name: 5-(2-tert-butyl-5-methyl-anilino)-6-hydroxy-2-phenethyl-2-phenyl-3H-pyran-4-one Formula: C30H33NO3 MolecularWeight: 455.58792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)(C)C)NC2=C(OC(CC2=O)(CCC3=CC=CC=C3)C4=CC=CC=C4)O

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)(C)C)NC2=C(OC(CC2=O)(CCC3=CC=CC=C3)C4=CC=CC=C4)O

InChI

InChI=1S/C30H33NO3/c1-21-15-16-24(29(2,3)4)25(19-21)31-27-26(32)20-30(34-28(27)33,23-13-9-6-10-14-23)18-17-22-11-7-5-8-12-22/h5-16,19,31,33H,17-18,20H2,1-4H3