2-[(3,5-ditert-butylphenyl)methoxy]-4-(1H-imidazol-2-ylmethyl)-3-phenyl-morpholine

Systemtic Name: 2-[(3,5-ditert-butylphenyl)methoxy]-4-(1H-imidazol-2-ylmethyl)-3-phenyl-morpholine Openeye Name: 2-[(3,5-ditert-butylphenyl)methoxy]-4-(1H-imidazol-2-ylmethyl)-3-phenyl-morpholine CAS Name: 2-[(3,5-ditert-butylphenyl)methoxy]-4-(1H-imidazol-2-ylmethyl)-3-phenylmorpholine IUPAC Name: 2-[(3,5-ditert-butylphenyl)methoxy]-4-(1H-imidazol-2-ylmethyl)-3-phenylmorpholine Traditional Name: 2-(3,5-ditert-butylbenzyl)oxy-4-(1H-imidazol-2-ylmethyl)-3-phenyl-morpholine Formula: C29H39N3O2 MolecularWeight: 461.63886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)COC2C(N(CCO2)CC3=NC=CN3)C4=CC=CC=C4)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)COC2C(N(CCO2)CC3=NC=CN3)C4=CC=CC=C4)C(C)(C)C

InChI

InChI=1S/C29H39N3O2/c1-28(2,3)23-16-21(17-24(18-23)29(4,5)6)20-34-27-26(22-10-8-7-9-11-22)32(14-15-33-27)19-25-30-12-13-31-25/h7-13,16-18,26-27H,14-15,19-20H2,1-6H3,(H,30,31)