2-nitro-6-[(4-phenylmethoxyphenyl)methoxy]-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine

Systemtic Name: 2-nitro-6-[(4-phenylmethoxyphenyl)methoxy]-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine Openeye Name: 6-[(4-benzyloxyphenyl)methoxy]-2-nitro-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine CAS Name: 2-nitro-6-[(4-phenylmethoxyphenyl)methoxy]-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine IUPAC Name: 2-nitro-6-[(4-phenylmethoxyphenyl)methoxy]-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine Traditional Name: 6-(4-benzoxybenzyl)oxy-2-nitro-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine Formula: C20H20N4O4 MolecularWeight: 380.3972

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN2C(=N1)C=C(N2)[N+](=O)[O-])OCC3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1C(CN2C(=N1)C=C(N2)[N+](=O)[O-])OCC3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C20H20N4O4/c25-24(26)20-10-19-21-11-18(12-23(19)22-20)28-14-16-6-8-17(9-7-16)27-13-15-4-2-1-3-5-15/h1-10,18,22H,11-14H2