N-(2-azanylcyclohexyl)-N-[[4-(2-phenoxyethanoylamino)phenyl]methyl]cyclohexanecarboxamide

Systemtic Name: N-(2-azanylcyclohexyl)-N-[[4-(2-phenoxyethanoylamino)phenyl]methyl]cyclohexanecarboxamide Openeye Name: N-(2-aminocyclohexyl)-N-[[4-[(2-phenoxyacetyl)amino]phenyl]methyl]cyclohexanecarboxamide CAS Name: N-(2-aminocyclohexyl)-N-[[4-[(1-oxo-2-phenoxyethyl)amino]phenyl]methyl]cyclohexanecarboxamide IUPAC Name: N-(2-aminocyclohexyl)-N-[[4-[(2-phenoxyacetyl)amino]phenyl]methyl]cyclohexanecarboxamide Traditional Name: N-(2-aminocyclohexyl)-N-[4-[(2-phenoxyacetyl)amino]benzyl]cyclohexanecarboxamide Formula: C28H37N3O3 MolecularWeight: 463.61168

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N(CC2=CC=C(C=C2)NC(=O)COC3=CC=CC=C3)C4CCCCC4N

Isomeric SMILES

C1CCC(CC1)C(=O)N(CC2=CC=C(C=C2)NC(=O)COC3=CC=CC=C3)C4CCCCC4N

InChI

InChI=1S/C28H37N3O3/c29-25-13-7-8-14-26(25)31(28(33)22-9-3-1-4-10-22)19-21-15-17-23(18-16-21)30-27(32)20-34-24-11-5-2-6-12-24/h2,5-6,11-12,15-18,22,25-26H,1,3-4,7-10,13-14,19-20,29H2,(H,30,32)