8-nitro-5-(4-phenoxyphenoxy)isoquinoline

Systemtic Name: 8-nitro-5-(4-phenoxyphenoxy)isoquinoline Openeye Name: 8-nitro-5-(4-phenoxyphenoxy)isoquinoline CAS Name: 8-nitro-5-(4-phenoxyphenoxy)isoquinoline IUPAC Name: 8-nitro-5-(4-phenoxyphenoxy)isoquinoline Traditional Name: 8-nitro-5-(4-phenoxyphenoxy)isoquinoline Formula: C21H14N2O4 MolecularWeight: 358.34686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)OC3=C4C=CN=CC4=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)OC3=C4C=CN=CC4=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H14N2O4/c24-23(25)20-10-11-21(18-12-13-22-14-19(18)20)27-17-8-6-16(7-9-17)26-15-4-2-1-3-5-15/h1-14H