N-[4-(4-chlorophenyl)-3-phenyl-butan-2-yl]-1-(1-oxidanidylpyridin-1-ium-3-yl)cyclopentane-1-carboxamide

Systemtic Name: N-[4-(4-chlorophenyl)-3-phenyl-butan-2-yl]-1-(1-oxidanidylpyridin-1-ium-3-yl)cyclopentane-1-carboxamide Openeye Name: N-[3-(4-chlorophenyl)-1-methyl-2-phenyl-propyl]-1-(1-oxidopyridin-1-ium-3-yl)cyclopentanecarboxamide CAS Name: N-[4-(4-chlorophenyl)-3-phenylbutan-2-yl]-1-(1-oxido-3-pyridin-1-iumyl)-1-cyclopentanecarboxamide IUPAC Name: N-[4-(4-chlorophenyl)-3-phenylbutan-2-yl]-1-(1-oxidopyridin-1-ium-3-yl)cyclopentane-1-carboxamide Traditional Name: N-[3-(4-chlorophenyl)-1-methyl-2-phenyl-propyl]-1-(1-oxidopyridin-1-ium-3-yl)cyclopentanecarboxamide Formula: C27H29ClN2O2 MolecularWeight: 448.98436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(CC1=CC=C(C=C1)Cl)C2=CC=CC=C2)NC(=O)C3(CCCC3)C4=C[N+](=CC=C4)[O-]

Isomeric SMILES

CC(C(CC1=CC=C(C=C1)Cl)C2=CC=CC=C2)NC(=O)C3(CCCC3)C4=C[N+](=CC=C4)[O-]

InChI

InChI=1S/C27H29ClN2O2/c1-20(25(22-8-3-2-4-9-22)18-21-11-13-24(28)14-12-21)29-26(31)27(15-5-6-16-27)23-10-7-17-30(32)19-23/h2-4,7-14,17,19-20,25H,5-6,15-16,18H2,1H3,(H,29,31)