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

Systemtic Name: N-[(E)-(3-bromanyl-4-methoxy-phenyl)methylideneamino]-5-naphthalen-2-yl-pyrazolidine-3-carboxamide Openeye Name: N-[(E)-(3-bromo-4-methoxy-phenyl)methyleneamino]-5-(2-naphthyl)pyrazolidine-3-carboxamide CAS Name: N-[(E)-(3-bromo-4-methoxyphenyl)methylideneamino]-5-(2-naphthalenyl)-3-pyrazolidinecarboxamide IUPAC Name: N-[(E)-(3-bromo-4-methoxyphenyl)methylideneamino]-5-naphthalen-2-ylpyrazolidine-3-carboxamide Traditional Name: N-[(E)-(3-bromo-4-methoxy-benzylidene)amino]-5-(2-naphthyl)pyrazolidine-3-carboxamide Formula: C22H21BrN4O2 MolecularWeight: 453.33174

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC(=O)C2CC(NN2)C3=CC4=CC=CC=C4C=C3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N/NC(=O)C2CC(NN2)C3=CC4=CC=CC=C4C=C3)Br

InChI

InChI=1S/C22H21BrN4O2/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/h2-11,13,19-20,25-26H,12H2,1H3,(H,27,28)/b24-13+