6-[(4-nitrophenyl)methyl]-3,4-dihydro-2H-pyrimido[1,2-b]isoindol-6-ol

Systemtic Name: 6-[(4-nitrophenyl)methyl]-3,4-dihydro-2H-pyrimido[1,2-b]isoindol-6-ol Openeye Name: 6-[(4-nitrophenyl)methyl]-3,4-dihydro-2H-pyrimido[1,2-b]isoindol-6-ol CAS Name: 6-[(4-nitrophenyl)methyl]-3,4-dihydro-2H-pyrimido[1,2-b]isoindol-6-ol IUPAC Name: 6-[(4-nitrophenyl)methyl]-3,4-dihydro-2H-pyrimido[1,2-b]isoindol-6-ol Traditional Name: 6-(4-nitrobenzyl)-3,4-dihydro-2H-pyrimid[1,2-b]isoindol-6-ol Formula: C18H17N3O3 MolecularWeight: 323.34588

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C2C3=CC=CC=C3C(N2C1)(CC4=CC=C(C=C4)[N+](=O)[O-])O

Isomeric SMILES

C1CN=C2C3=CC=CC=C3C(N2C1)(CC4=CC=C(C=C4)[N+](=O)[O-])O

InChI

InChI=1S/C18H17N3O3/c22-18(12-13-6-8-14(9-7-13)21(23)24)16-5-2-1-4-15(16)17-19-10-3-11-20(17)18/h1-2,4-9,22H,3,10-12H2