4-chloranyl-7-[(3,5-dimethoxy-2-nitro-phenyl)methyl]pyrrolo[2,3-d]pyrimidin-2-amine

Systemtic Name: 4-chloranyl-7-[(3,5-dimethoxy-2-nitro-phenyl)methyl]pyrrolo[2,3-d]pyrimidin-2-amine Openeye Name: 4-chloro-7-[(3,5-dimethoxy-2-nitro-phenyl)methyl]pyrrolo[2,3-d]pyrimidin-2-amine CAS Name: 4-chloro-7-[(3,5-dimethoxy-2-nitrophenyl)methyl]-2-pyrrolo[2,3-d]pyrimidinamine IUPAC Name: 4-chloro-7-[(3,5-dimethoxy-2-nitrophenyl)methyl]pyrrolo[2,3-d]pyrimidin-2-amine Traditional Name: [4-chloro-7-(3,5-dimethoxy-2-nitro-benzyl)pyrrolo[2,3-d]pyrimidin-2-yl]amine Formula: C15H14ClN5O4 MolecularWeight: 363.75576

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)CN2C=CC3=C2N=C(N=C3Cl)N)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=C(C(=C1)CN2C=CC3=C2N=C(N=C3Cl)N)[N+](=O)[O-])OC

InChI

InChI=1S/C15H14ClN5O4/c1-24-9-5-8(12(21(22)23)11(6-9)25-2)7-20-4-3-10-13(16)18-15(17)19-14(10)20/h3-6H,7H2,1-2H3,(H2,17,18,19)