(3S,6R)-1,4-bis[(4-methoxyphenyl)methyl]-3-propan-2-yl-6-prop-2-ynyl-piperazine-2,5-dione

Systemtic Name: (3S,6R)-1,4-bis[(4-methoxyphenyl)methyl]-3-propan-2-yl-6-prop-2-ynyl-piperazine-2,5-dione Openeye Name: (3S,6R)-3-isopropyl-1,4-bis[(4-methoxyphenyl)methyl]-6-prop-2-ynyl-piperazine-2,5-dione CAS Name: (3S,6R)-1,4-bis[(4-methoxyphenyl)methyl]-3-propan-2-yl-6-prop-2-ynylpiperazine-2,5-dione IUPAC Name: (3S,6R)-1,4-bis[(4-methoxyphenyl)methyl]-3-propan-2-yl-6-prop-2-ynylpiperazine-2,5-dione Traditional Name: (3S,6R)-3-isopropyl-1,4-bis(p-anisyl)-6-propargyl-piperazine-2,5-quinone Formula: C26H30N2O4 MolecularWeight: 434.5274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=O)N(C(C(=O)N1CC2=CC=C(C=C2)OC)CC#C)CC3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)[C@H]1C(=O)N([C@@H](C(=O)N1CC2=CC=C(C=C2)OC)CC#C)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C26H30N2O4/c1-6-7-23-25(29)28(17-20-10-14-22(32-5)15-11-20)24(18(2)3)26(30)27(23)16-19-8-12-21(31-4)13-9-19/h1,8-15,18,23-24H,7,16-17H2,2-5H3/t23-,24+/m1/s1