2-[(2S)-4-(3-methoxyphenyl)-2-(phenylmethyl)piperazin-1-yl]-N-(2-phenoxyethyl)ethanamine

Systemtic Name: 2-[(2S)-4-(3-methoxyphenyl)-2-(phenylmethyl)piperazin-1-yl]-N-(2-phenoxyethyl)ethanamine Openeye Name: 2-[(2S)-2-benzyl-4-(3-methoxyphenyl)piperazin-1-yl]-N-(2-phenoxyethyl)ethanamine CAS Name: 2-[(2S)-4-(3-methoxyphenyl)-2-(phenylmethyl)-1-piperazinyl]-N-(2-phenoxyethyl)ethanamine IUPAC Name: 2-[(2S)-2-benzyl-4-(3-methoxyphenyl)piperazin-1-yl]-N-(2-phenoxyethyl)ethanamine Traditional Name: 2-[(2S)-2-benzyl-4-(3-methoxyphenyl)piperazino]ethyl-(2-phenoxyethyl)amine Formula: C28H35N3O2 MolecularWeight: 445.5964

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(C(C2)CC3=CC=CC=C3)CCNCCOC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN([C@H](C2)CC3=CC=CC=C3)CCNCCOC4=CC=CC=C4

InChI

InChI=1S/C28H35N3O2/c1-32-28-14-8-11-25(22-28)31-19-18-30(26(23-31)21-24-9-4-2-5-10-24)17-15-29-16-20-33-27-12-6-3-7-13-27/h2-14,22,26,29H,15-21,23H2,1H3/t26-/m0/s1