1-benzofuran-2-yl-[(3S)-4-[(4-methylphenyl)methyl]-3-(phenylmethyl)piperazin-1-yl]methanone

Systemtic Name: 1-benzofuran-2-yl-[(3S)-4-[(4-methylphenyl)methyl]-3-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: benzofuran-2-yl-[(3S)-3-benzyl-4-(p-tolylmethyl)piperazin-1-yl]methanone CAS Name: 2-benzofuranyl-[(3S)-4-[(4-methylphenyl)methyl]-3-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: 1-benzofuran-2-yl-[(3S)-3-benzyl-4-[(4-methylphenyl)methyl]piperazin-1-yl]methanone Traditional Name: benzofuran-2-yl-[(3S)-3-benzyl-4-(4-methylbenzyl)piperazino]methanone Formula: C28H28N2O2 MolecularWeight: 424.53412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCN(CC2CC3=CC=CC=C3)C(=O)C4=CC5=CC=CC=C5O4

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCN(C[C@@H]2CC3=CC=CC=C3)C(=O)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C28H28N2O2/c1-21-11-13-23(14-12-21)19-29-15-16-30(20-25(29)17-22-7-3-2-4-8-22)28(31)27-18-24-9-5-6-10-26(24)32-27/h2-14,18,25H,15-17,19-20H2,1H3/t25-/m0/s1