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

Systemtic Name: N-[(2S)-1-[(4-methoxyphenyl)amino]butan-2-yl]-1-[(3-phenylphenyl)amino]cyclohexane-1-carboxamide Openeye Name: N-[(1S)-1-[(4-methoxyanilino)methyl]propyl]-1-(3-phenylanilino)cyclohexanecarboxamide CAS Name: N-[(2S)-1-(4-methoxyanilino)butan-2-yl]-1-(3-phenylanilino)-1-cyclohexanecarboxamide IUPAC Name: N-[(2S)-1-(4-methoxyanilino)butan-2-yl]-1-(3-phenylanilino)cyclohexane-1-carboxamide Traditional Name: N-[(1S)-1-(p-anisidinomethyl)propyl]-1-(3-phenylanilino)cyclohexanecarboxamide Formula: C30H37N3O2 MolecularWeight: 471.63368

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC1=CC=C(C=C1)OC)NC(=O)C2(CCCCC2)NC3=CC=CC(=C3)C4=CC=CC=C4

Isomeric SMILES

CC[C@@H](CNC1=CC=C(C=C1)OC)NC(=O)C2(CCCCC2)NC3=CC=CC(=C3)C4=CC=CC=C4

InChI

InChI=1S/C30H37N3O2/c1-3-25(22-31-26-15-17-28(35-2)18-16-26)32-29(34)30(19-8-5-9-20-30)33-27-14-10-13-24(21-27)23-11-6-4-7-12-23/h4,6-7,10-18,21,25,31,33H,3,5,8-9,19-20,22H2,1-2H3,(H,32,34)/t25-/m0/s1