N-(3-azanylpropyl)-N-[[4-(2-phenoxyethanoylamino)phenyl]methyl]cyclohexanecarboxamide

Systemtic Name: N-(3-azanylpropyl)-N-[[4-(2-phenoxyethanoylamino)phenyl]methyl]cyclohexanecarboxamide Openeye Name: N-(3-aminopropyl)-N-[[4-[(2-phenoxyacetyl)amino]phenyl]methyl]cyclohexanecarboxamide CAS Name: N-(3-aminopropyl)-N-[[4-[(1-oxo-2-phenoxyethyl)amino]phenyl]methyl]cyclohexanecarboxamide IUPAC Name: N-(3-aminopropyl)-N-[[4-[(2-phenoxyacetyl)amino]phenyl]methyl]cyclohexanecarboxamide Traditional Name: N-(3-aminopropyl)-N-[4-[(2-phenoxyacetyl)amino]benzyl]cyclohexanecarboxamide Formula: C25H33N3O3 MolecularWeight: 423.54782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H33N3O3/c26-16-7-17-28(25(30)21-8-3-1-4-9-21)18-20-12-14-22(15-13-20)27-24(29)19-31-23-10-5-2-6-11-23/h2,5-6,10-15,21H,1,3-4,7-9,16-19,26H2,(H,27,29)