N-[3-[[(4-azanylcyclohexyl)-ethanoyl-amino]methyl]-4-chloranyl-phenyl]cyclopentanecarboxamide

Systemtic Name: N-[3-[[(4-azanylcyclohexyl)-ethanoyl-amino]methyl]-4-chloranyl-phenyl]cyclopentanecarboxamide Openeye Name: N-[3-[[acetyl-(4-aminocyclohexyl)amino]methyl]-4-chloro-phenyl]cyclopentanecarboxamide CAS Name: N-[3-[[acetyl-(4-aminocyclohexyl)amino]methyl]-4-chlorophenyl]cyclopentanecarboxamide IUPAC Name: N-[3-[[acetyl-(4-aminocyclohexyl)amino]methyl]-4-chlorophenyl]cyclopentanecarboxamide Traditional Name: N-[3-[[acetyl-(4-aminocyclohexyl)amino]methyl]-4-chloro-phenyl]cyclopentanecarboxamide Formula: C21H30ClN3O2 MolecularWeight: 391.9348

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CC1=C(C=CC(=C1)NC(=O)C2CCCC2)Cl)C3CCC(CC3)N

Isomeric SMILES

CC(=O)N(CC1=C(C=CC(=C1)NC(=O)C2CCCC2)Cl)C3CCC(CC3)N

InChI

InChI=1S/C21H30ClN3O2/c1-14(26)25(19-9-6-17(23)7-10-19)13-16-12-18(8-11-20(16)22)24-21(27)15-4-2-3-5-15/h8,11-12,15,17,19H,2-7,9-10,13,23H2,1H3,(H,24,27)