4-chloranyl-N-[(E)-(3-methoxyphenyl)methylideneamino]phthalazin-1-amine

Systemtic Name: 4-chloranyl-N-[(E)-(3-methoxyphenyl)methylideneamino]phthalazin-1-amine Openeye Name: 4-chloro-N-[(E)-(3-methoxyphenyl)methyleneamino]phthalazin-1-amine CAS Name: 4-chloro-N-[(E)-(3-methoxyphenyl)methylideneamino]-1-phthalazinamine IUPAC Name: 4-chloro-N-[(E)-(3-methoxyphenyl)methylideneamino]phthalazin-1-amine Traditional Name: (4-chlorophthalazin-1-yl)-[(E)-m-anisylideneamino]amine Formula: C16H13ClN4O MolecularWeight: 312.75362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C=NNC2=NN=C(C3=CC=CC=C32)Cl

Isomeric SMILES

COC1=CC=CC(=C1)/C=N/NC2=NN=C(C3=CC=CC=C32)Cl

InChI

InChI=1S/C16H13ClN4O/c1-22-12-6-4-5-11(9-12)10-18-20-16-14-8-3-2-7-13(14)15(17)19-21-16/h2-10H,1H3,(H,20,21)/b18-10+