N-[(E)-(3-bromanyl-4-methoxy-phenyl)methylideneamino]-3-naphthalen-2-yl-1H-pyrazole-5-carboxamide

Systemtic Name: N-[(E)-(3-bromanyl-4-methoxy-phenyl)methylideneamino]-3-naphthalen-2-yl-1H-pyrazole-5-carboxamide Openeye Name: N-[(E)-(3-bromo-4-methoxy-phenyl)methyleneamino]-3-(2-naphthyl)-1H-pyrazole-5-carboxamide CAS Name: N-[(E)-(3-bromo-4-methoxyphenyl)methylideneamino]-3-(2-naphthalenyl)-1H-pyrazole-5-carboxamide IUPAC Name: N-[(E)-(3-bromo-4-methoxyphenyl)methylideneamino]-3-naphthalen-2-yl-1H-pyrazole-5-carboxamide Traditional Name: N-[(E)-(3-bromo-4-methoxy-benzylidene)amino]-3-(2-naphthyl)-1H-pyrazole-5-carboxamide Formula: C22H17BrN4O2 MolecularWeight: 449.29998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC(=O)C2=CC(=NN2)C3=CC4=CC=CC=C4C=C3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N/NC(=O)C2=CC(=NN2)C3=CC4=CC=CC=C4C=C3)Br

InChI

InChI=1S/C22H17BrN4O2/c1-29-21-9-6-14(10-18(21)23)13-24-27-22(28)20-12-19(25-26-20)17-8-7-15-4-2-3-5-16(15)11-17/h2-13H,1H3,(H,25,26)(H,27,28)/b24-13+