(2R,5S)-3,6-dimethoxy-2-[(1R)-1-naphthalen-1-yl-2-nitro-ethyl]-5-propan-2-yl-2,5-dihydropyrazine

Systemtic Name: (2R,5S)-3,6-dimethoxy-2-[(1R)-1-naphthalen-1-yl-2-nitro-ethyl]-5-propan-2-yl-2,5-dihydropyrazine Openeye Name: (2S,5R)-2-isopropyl-3,6-dimethoxy-5-[(1R)-1-(1-naphthyl)-2-nitro-ethyl]-2,5-dihydropyrazine CAS Name: (2R,5S)-3,6-dimethoxy-2-[(1R)-1-(1-naphthalenyl)-2-nitroethyl]-5-propan-2-yl-2,5-dihydropyrazine IUPAC Name: (2R,5S)-3,6-dimethoxy-2-[(1R)-1-naphthalen-1-yl-2-nitroethyl]-5-propan-2-yl-2,5-dihydropyrazine Traditional Name: (2S,5R)-2-isopropyl-3,6-dimethoxy-5-[(1R)-1-(1-naphthyl)-2-nitro-ethyl]-2,5-dihydropyrazine Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=NC(C(=N1)OC)C(C[N+](=O)[O-])C2=CC=CC3=CC=CC=C32)OC

Isomeric SMILES

CC(C)[C@H]1C(=N[C@@H](C(=N1)OC)[C@@H](C[N+](=O)[O-])C2=CC=CC3=CC=CC=C32)OC

InChI

InChI=1S/C21H25N3O4/c1-13(2)18-20(27-3)23-19(21(22-18)28-4)17(12-24(25)26)16-11-7-9-14-8-5-6-10-15(14)16/h5-11,13,17-19H,12H2,1-4H3/t17-,18-,19+/m0/s1