N-[4-[[[(2S)-2-(4-methylphenoxy)butanoyl]amino]carbamoyl]phenyl]cyclohexanecarboxamide

Systemtic Name: N-[4-[[[(2S)-2-(4-methylphenoxy)butanoyl]amino]carbamoyl]phenyl]cyclohexanecarboxamide Openeye Name: N-[4-[[[(2S)-2-(4-methylphenoxy)butanoyl]amino]carbamoyl]phenyl]cyclohexanecarboxamide CAS Name: N-[4-[[[(2S)-2-(4-methylphenoxy)-1-oxobutyl]hydrazo]-oxomethyl]phenyl]cyclohexanecarboxamide IUPAC Name: N-[4-[[[(2S)-2-(4-methylphenoxy)butanoyl]amino]carbamoyl]phenyl]cyclohexanecarboxamide Traditional Name: N-[4-[[[(2S)-2-(4-methylphenoxy)butanoyl]amino]carbamoyl]phenyl]cyclohexanecarboxamide Formula: C25H31N3O4 MolecularWeight: 437.53134

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NNC(=O)C1=CC=C(C=C1)NC(=O)C2CCCCC2)OC3=CC=C(C=C3)C

Isomeric SMILES

CC[C@@H](C(=O)NNC(=O)C1=CC=C(C=C1)NC(=O)C2CCCCC2)OC3=CC=C(C=C3)C

InChI

InChI=1S/C25H31N3O4/c1-3-22(32-21-15-9-17(2)10-16-21)25(31)28-27-24(30)19-11-13-20(14-12-19)26-23(29)18-7-5-4-6-8-18/h9-16,18,22H,3-8H2,1-2H3,(H,26,29)(H,27,30)(H,28,31)/t22-/m0/s1