N'-[(3-bromanyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylideneamino]-N-(2,3-dimethylphenyl)butanediamide

Systemtic Name: N'-[(3-bromanyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylideneamino]-N-(2,3-dimethylphenyl)butanediamide Openeye Name: N'-[(3-bromo-5-methoxy-4-prop-2-ynoxy-phenyl)methyleneamino]-N-(2,3-dimethylphenyl)butanediamide CAS Name: N'-[(3-bromo-5-methoxy-4-prop-2-ynoxyphenyl)methylideneamino]-N-(2,3-dimethylphenyl)butanediamide IUPAC Name: N'-[(3-bromo-5-methoxy-4-prop-2-ynoxyphenyl)methylideneamino]-N-(2,3-dimethylphenyl)butanediamide Traditional Name: N'-[(3-bromo-5-methoxy-4-propargyloxy-benzylidene)amino]-N-(2,3-dimethylphenyl)succinamide Formula: C23H24BrN3O4 MolecularWeight: 486.35836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)CCC(=O)NN=CC2=CC(=C(C(=C2)Br)OCC#C)OC)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)CCC(=O)NN=CC2=CC(=C(C(=C2)Br)OCC#C)OC)C

InChI

InChI=1S/C23H24BrN3O4/c1-5-11-31-23-18(24)12-17(13-20(23)30-4)14-25-27-22(29)10-9-21(28)26-19-8-6-7-15(2)16(19)3/h1,6-8,12-14H,9-11H2,2-4H3,(H,26,28)(H,27,29)