(2S,5R)-2-[(4-bromophenyl)methyl]-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazine

Systemtic Name: (2S,5R)-2-[(4-bromophenyl)methyl]-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazine Openeye Name: (2S,5R)-2-[(4-bromophenyl)methyl]-5-isopropyl-3,6-dimethoxy-2,5-dihydropyrazine CAS Name: (2S,5R)-2-[(4-bromophenyl)methyl]-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazine IUPAC Name: (2S,5R)-2-[(4-bromophenyl)methyl]-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazine Traditional Name: (2S,5R)-2-(4-bromobenzyl)-5-isopropyl-3,6-dimethoxy-2,5-dihydropyrazine Formula: C16H21BrN2O2 MolecularWeight: 353.25414

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)[C@@H]1C(=N[C@H](C(=N1)OC)CC2=CC=C(C=C2)Br)OC

InChI

InChI=1S/C16H21BrN2O2/c1-10(2)14-16(21-4)18-13(15(19-14)20-3)9-11-5-7-12(17)8-6-11/h5-8,10,13-14H,9H2,1-4H3/t13-,14+/m0/s1