3-tert-butyl-7-(1,4-diphenylbutoxy)chromen-4-one; methanamine

Systemtic Name: 3-tert-butyl-7-(1,4-diphenylbutoxy)chromen-4-one; methanamine Openeye Name: 3-tert-butyl-7-(1,4-diphenylbutoxy)chromen-4-one; methanamine CAS Name: 3-tert-butyl-7-(1,4-diphenylbutoxy)-1-benzopyran-4-one; methanamine IUPAC Name: 3-tert-butyl-7-(1,4-diphenylbutoxy)chromen-4-one; methanamine Traditional Name: 3-tert-butyl-7-(1,4-diphenylbutoxy)chromone; methylamine Formula: C30H35NO3 MolecularWeight: 457.6038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=COC2=C(C1=O)C=CC(=C2)OC(CCCC3=CC=CC=C3)C4=CC=CC=C4.CN

Isomeric SMILES

CC(C)(C)C1=COC2=C(C1=O)C=CC(=C2)OC(CCCC3=CC=CC=C3)C4=CC=CC=C4.CN

InChI

InChI=1S/C29H30O3.CH5N/c1-29(2,3)25-20-31-27-19-23(17-18-24(27)28(25)30)32-26(22-14-8-5-9-15-22)16-10-13-21-11-6-4-7-12-21;1-2/h4-9,11-12,14-15,17-20,26H,10,13,16H2,1-3H3;2H2,1H3