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

Systemtic Name: N'-[(5-bromanyl-2-prop-2-ynoxy-phenyl)methylideneamino]-N-(2,5-dimethylphenyl)butanediamide Openeye Name: N'-[(5-bromo-2-prop-2-ynoxy-phenyl)methyleneamino]-N-(2,5-dimethylphenyl)butanediamide CAS Name: N'-[(5-bromo-2-prop-2-ynoxyphenyl)methylideneamino]-N-(2,5-dimethylphenyl)butanediamide IUPAC Name: N'-[(5-bromo-2-prop-2-ynoxyphenyl)methylideneamino]-N-(2,5-dimethylphenyl)butanediamide Traditional Name: N'-[(5-bromo-2-propargyloxy-benzylidene)amino]-N-(2,5-dimethylphenyl)succinamide Formula: C22H22BrN3O3 MolecularWeight: 456.33238

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22BrN3O3/c1-4-11-29-20-8-7-18(23)13-17(20)14-24-26-22(28)10-9-21(27)25-19-12-15(2)5-6-16(19)3/h1,5-8,12-14H,9-11H2,2-3H3,(H,25,27)(H,26,28)