1-butoxy-2-(2,4-dinitrophenyl)-1H-isoquinoline

Systemtic Name: 1-butoxy-2-(2,4-dinitrophenyl)-1H-isoquinoline Openeye Name: 1-butoxy-2-(2,4-dinitrophenyl)-1H-isoquinoline CAS Name: 1-butoxy-2-(2,4-dinitrophenyl)-1H-isoquinoline IUPAC Name: 1-butoxy-2-(2,4-dinitrophenyl)-1H-isoquinoline Traditional Name: 1-butoxy-2-(2,4-dinitrophenyl)-1H-isoquinoline Formula: C19H19N3O5 MolecularWeight: 369.37126

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1C2=CC=CC=C2C=CN1C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCOC1C2=CC=CC=C2C=CN1C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O5/c1-2-3-12-27-19-16-7-5-4-6-14(16)10-11-20(19)17-9-8-15(21(23)24)13-18(17)22(25)26/h4-11,13,19H,2-3,12H2,1H3