2-(6-chloranyl-5-nitro-pyrimidin-4-yl)-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-(6-chloranyl-5-nitro-pyrimidin-4-yl)-3,4-dihydro-1H-isoquinoline Openeye Name: 2-(6-chloro-5-nitro-pyrimidin-4-yl)-3,4-dihydro-1H-isoquinoline CAS Name: 2-(6-chloro-5-nitro-4-pyrimidinyl)-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-(6-chloro-5-nitropyrimidin-4-yl)-3,4-dihydro-1H-isoquinoline Traditional Name: 2-(6-chloro-5-nitro-pyrimidin-4-yl)-3,4-dihydro-1H-isoquinoline Formula: C13H11ClN4O2 MolecularWeight: 290.70504

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=C(C(=NC=N3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=C(C(=NC=N3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H11ClN4O2/c14-12-11(18(19)20)13(16-8-15-12)17-6-5-9-3-1-2-4-10(9)7-17/h1-4,8H,5-7H2