1-[6-(4-nitrophenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-3,4-dihydro-2H-quinoline

Systemtic Name: 1-[6-(4-nitrophenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-3,4-dihydro-2H-quinoline Openeye Name: 1-[6-(4-nitrophenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-3,4-dihydro-2H-quinoline CAS Name: 1-[6-(4-nitrophenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-3,4-dihydro-2H-quinoline IUPAC Name: 1-[6-(4-nitrophenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-3,4-dihydro-2H-quinoline Traditional Name: 1-[6-(4-nitrophenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-3,4-dihydro-2H-quinoline Formula: C21H17N5O2 MolecularWeight: 371.39198

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)C3=NC=NC4=C3C=C(N4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)C3=NC=NC4=C3C=C(N4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C21H17N5O2/c27-26(28)16-9-7-14(8-10-16)18-12-17-20(24-18)22-13-23-21(17)25-11-3-5-15-4-1-2-6-19(15)25/h1-2,4,6-10,12-13H,3,5,11H2,(H,22,23,24)