(3S,6S)-3-deuterio-3-[deuterio-(3,4-dimethoxyphenyl)methyl]-6-propan-2-yl-piperazine-2,5-dione

Systemtic Name: (3S,6S)-3-deuterio-3-[deuterio-(3,4-dimethoxyphenyl)methyl]-6-propan-2-yl-piperazine-2,5-dione Openeye Name: (3S,6S)-3-deuterio-3-[deuterio-(3,4-dimethoxyphenyl)methyl]-6-isopropyl-piperazine-2,5-dione CAS Name: (3S,6S)-3-deuterio-3-[deuterio-(3,4-dimethoxyphenyl)methyl]-6-propan-2-ylpiperazine-2,5-dione IUPAC Name: (3S,6S)-3-deuterio-3-[deuterio-(3,4-dimethoxyphenyl)methyl]-6-propan-2-ylpiperazine-2,5-dione Traditional Name: (3S,6S)-3-deuterio-3-[deuterio-(3,4-dimethoxyphenyl)methyl]-6-isopropyl-piperazine-2,5-quinone Formula: C16H22N2O4 MolecularWeight: 308.369204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=O)NC(C(=O)N1)CC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

[2H]C(C1=CC(=C(C=C1)OC)OC)[C@]2(C(=O)N[C@H](C(=O)N2)C(C)C)[2H]

InChI

InChI=1S/C16H22N2O4/c1-9(2)14-16(20)17-11(15(19)18-14)7-10-5-6-12(21-3)13(8-10)22-4/h5-6,8-9,11,14H,7H2,1-4H3,(H,17,20)(H,18,19)/t11-,14-/m0/s1/i7D,11D/t7?,11-,14-