N-[(2S)-1-[(4-phenylmethoxyphenyl)amino]butan-2-yl]-1-[(3-phenylphenyl)amino]cyclohexane-1-carboxamide

Systemtic Name: N-[(2S)-1-[(4-phenylmethoxyphenyl)amino]butan-2-yl]-1-[(3-phenylphenyl)amino]cyclohexane-1-carboxamide Openeye Name: N-[(1S)-1-[(4-benzyloxyanilino)methyl]propyl]-1-(3-phenylanilino)cyclohexanecarboxamide CAS Name: 1-(3-phenylanilino)-N-[(2S)-1-(4-phenylmethoxyanilino)butan-2-yl]-1-cyclohexanecarboxamide IUPAC Name: 1-(3-phenylanilino)-N-[(2S)-1-(4-phenylmethoxyanilino)butan-2-yl]cyclohexane-1-carboxamide Traditional Name: N-[(1S)-1-[(4-benzoxyanilino)methyl]propyl]-1-(3-phenylanilino)cyclohexanecarboxamide Formula: C36H41N3O2 MolecularWeight: 547.72964

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC1=CC=C(C=C1)OCC2=CC=CC=C2)NC(=O)C3(CCCCC3)NC4=CC=CC(=C4)C5=CC=CC=C5

Isomeric SMILES

CC[C@@H](CNC1=CC=C(C=C1)OCC2=CC=CC=C2)NC(=O)C3(CCCCC3)NC4=CC=CC(=C4)C5=CC=CC=C5

InChI

InChI=1S/C36H41N3O2/c1-2-31(26-37-32-19-21-34(22-20-32)41-27-28-13-6-3-7-14-28)38-35(40)36(23-10-5-11-24-36)39-33-18-12-17-30(25-33)29-15-8-4-9-16-29/h3-4,6-9,12-22,25,31,37,39H,2,5,10-11,23-24,26-27H2,1H3,(H,38,40)/t31-/m0/s1