N-(3,4-dichlorophenyl)-3-oxidanylidene-4-[[(3S)-1-phenethylpiperidin-3-yl]methyl]piperazine-1-carboxamide

Systemtic Name: N-(3,4-dichlorophenyl)-3-oxidanylidene-4-[[(3S)-1-phenethylpiperidin-3-yl]methyl]piperazine-1-carboxamide Openeye Name: N-(3,4-dichlorophenyl)-3-oxo-4-[[(3S)-1-phenethyl-3-piperidyl]methyl]piperazine-1-carboxamide CAS Name: N-(3,4-dichlorophenyl)-3-oxo-4-[[(3S)-1-phenethyl-3-piperidinyl]methyl]-1-piperazinecarboxamide IUPAC Name: N-(3,4-dichlorophenyl)-3-oxo-4-[[(3S)-1-phenethylpiperidin-3-yl]methyl]piperazine-1-carboxamide Traditional Name: N-(3,4-dichlorophenyl)-3-keto-4-[[(3S)-1-phenethyl-3-piperidyl]methyl]piperazine-1-carboxamide Formula: C25H30Cl2N4O2 MolecularWeight: 489.4373

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCC2=CC=CC=C2)CN3CCN(CC3=O)C(=O)NC4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1C[C@@H](CN(C1)CCC2=CC=CC=C2)CN3CCN(CC3=O)C(=O)NC4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C25H30Cl2N4O2/c26-22-9-8-21(15-23(22)27)28-25(33)31-14-13-30(24(32)18-31)17-20-7-4-11-29(16-20)12-10-19-5-2-1-3-6-19/h1-3,5-6,8-9,15,20H,4,7,10-14,16-18H2,(H,28,33)/t20-/m0/s1