4-bromanyl-N-[(Z)-(4-butoxy-3-ethoxy-phenyl)methylideneamino]-1H-pyrrole-2-carboxamide

Systemtic Name: 4-bromanyl-N-[(Z)-(4-butoxy-3-ethoxy-phenyl)methylideneamino]-1H-pyrrole-2-carboxamide Openeye Name: 4-bromo-N-[(Z)-(4-butoxy-3-ethoxy-phenyl)methyleneamino]-1H-pyrrole-2-carboxamide CAS Name: 4-bromo-N-[(Z)-(4-butoxy-3-ethoxyphenyl)methylideneamino]-1H-pyrrole-2-carboxamide IUPAC Name: 4-bromo-N-[(Z)-(4-butoxy-3-ethoxyphenyl)methylideneamino]-1H-pyrrole-2-carboxamide Traditional Name: 4-bromo-N-[(Z)-(4-butoxy-3-ethoxy-benzylidene)amino]-1H-pyrrole-2-carboxamide Formula: C18H22BrN3O3 MolecularWeight: 408.28958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=NNC(=O)C2=CC(=CN2)Br)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=N\NC(=O)C2=CC(=CN2)Br)OCC

InChI

InChI=1S/C18H22BrN3O3/c1-3-5-8-25-16-7-6-13(9-17(16)24-4-2)11-21-22-18(23)15-10-14(19)12-20-15/h6-7,9-12,20H,3-5,8H2,1-2H3,(H,22,23)/b21-11-