6-[(1S)-6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-[(1S)-6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-5-nitro-pyrimidin-4-amine Openeye Name: 6-[(1S)-6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-5-nitro-pyrimidin-4-amine CAS Name: 6-[(1S)-6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-5-nitro-4-pyrimidinamine IUPAC Name: 6-[(1S)-6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-5-nitropyrimidin-4-amine Traditional Name: [6-[(1S)-6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-5-nitro-pyrimidin-4-yl]amine Formula: C16H19N5O4 MolecularWeight: 345.35316

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC(=C(C=C2CCN1C3=C(C(=NC=N3)N)[N+](=O)[O-])OC)OC

Isomeric SMILES

C[C@H]1C2=CC(=C(C=C2CCN1C3=C(C(=NC=N3)N)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C16H19N5O4/c1-9-11-7-13(25-3)12(24-2)6-10(11)4-5-20(9)16-14(21(22)23)15(17)18-8-19-16/h6-9H,4-5H2,1-3H3,(H2,17,18,19)/t9-/m0/s1