6-(4-methoxy-3-nitro-phenyl)-3-propyl-[1,2,4]triazolo[3,4-a]phthalazine

Systemtic Name: 6-(4-methoxy-3-nitro-phenyl)-3-propyl-[1,2,4]triazolo[3,4-a]phthalazine Openeye Name: 6-(4-methoxy-3-nitro-phenyl)-3-propyl-[1,2,4]triazolo[3,4-a]phthalazine CAS Name: 6-(4-methoxy-3-nitrophenyl)-3-propyl-[1,2,4]triazolo[3,4-a]phthalazine IUPAC Name: 6-(4-methoxy-3-nitrophenyl)-3-propyl-[1,2,4]triazolo[3,4-a]phthalazine Traditional Name: 6-(4-methoxy-3-nitro-phenyl)-3-propyl-[1,2,4]triazolo[3,4-a]phthalazine Formula: C19H17N5O3 MolecularWeight: 363.36998

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C2N1N=C(C3=CC=CC=C32)C4=CC(=C(C=C4)OC)[N+](=O)[O-]

Isomeric SMILES

CCCC1=NN=C2N1N=C(C3=CC=CC=C32)C4=CC(=C(C=C4)OC)[N+](=O)[O-]

InChI

InChI=1S/C19H17N5O3/c1-3-6-17-20-21-19-14-8-5-4-7-13(14)18(22-23(17)19)12-9-10-16(27-2)15(11-12)24(25)26/h4-5,7-11H,3,6H2,1-2H3