N-[(2S)-1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-phenyl-propan-2-yl]-1-methyl-cyclohexane-1-carboxamide

Systemtic Name: N-[(2S)-1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-phenyl-propan-2-yl]-1-methyl-cyclohexane-1-carboxamide Openeye Name: N-[(1S)-1-benzyl-2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-1-methyl-cyclohexanecarboxamide CAS Name: N-[(2S)-1-[4-(2-methoxyphenyl)-1-piperazinyl]-3-phenylpropan-2-yl]-1-methyl-1-cyclohexanecarboxamide IUPAC Name: N-[(2S)-1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-phenylpropan-2-yl]-1-methylcyclohexane-1-carboxamide Traditional Name: N-[(1S)-1-benzyl-2-[4-(2-methoxyphenyl)piperazino]ethyl]-1-methyl-cyclohexanecarboxamide Formula: C28H39N3O2 MolecularWeight: 449.62816

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCCC1)C(=O)NC(CC2=CC=CC=C2)CN3CCN(CC3)C4=CC=CC=C4OC

Isomeric SMILES

CC1(CCCCC1)C(=O)N[C@@H](CC2=CC=CC=C2)CN3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C28H39N3O2/c1-28(15-9-4-10-16-28)27(32)29-24(21-23-11-5-3-6-12-23)22-30-17-19-31(20-18-30)25-13-7-8-14-26(25)33-2/h3,5-8,11-14,24H,4,9-10,15-22H2,1-2H3,(H,29,32)/t24-/m0/s1