3-[[2-tert-butyl-4-(hydroxymethyl)-5-methyl-phenyl]amino]-6-phenethyl-6-phenyl-oxane-2,4-dione

Systemtic Name: 3-[[2-tert-butyl-4-(hydroxymethyl)-5-methyl-phenyl]amino]-6-phenethyl-6-phenyl-oxane-2,4-dione Openeye Name: 3-[2-tert-butyl-4-(hydroxymethyl)-5-methyl-anilino]-6-phenethyl-6-phenyl-tetrahydropyran-2,4-dione CAS Name: 3-[2-tert-butyl-4-(hydroxymethyl)-5-methylanilino]-6-phenethyl-6-phenyloxane-2,4-dione IUPAC Name: 3-[2-tert-butyl-4-(hydroxymethyl)-5-methylanilino]-6-phenethyl-6-phenyloxane-2,4-dione Traditional Name: 3-(2-tert-butyl-5-methyl-4-methylol-anilino)-6-phenethyl-6-phenyl-tetrahydropyran-2,4-quinone Formula: C31H35NO4 MolecularWeight: 485.6139

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CO)C(C)(C)C)NC2C(=O)CC(OC2=O)(CCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1CO)C(C)(C)C)NC2C(=O)CC(OC2=O)(CCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C31H35NO4/c1-21-17-26(25(30(2,3)4)18-23(21)20-33)32-28-27(34)19-31(36-29(28)35,24-13-9-6-10-14-24)16-15-22-11-7-5-8-12-22/h5-14,17-18,28,32-33H,15-16,19-20H2,1-4H3