N-[(5-bromanyl-2-prop-2-ynoxy-phenyl)methylideneamino]-2-[2-(4-methoxyphenyl)ethanoylamino]propanamide

Systemtic Name: N-[(5-bromanyl-2-prop-2-ynoxy-phenyl)methylideneamino]-2-[2-(4-methoxyphenyl)ethanoylamino]propanamide Openeye Name: N-[(5-bromo-2-prop-2-ynoxy-phenyl)methyleneamino]-2-[[2-(4-methoxyphenyl)acetyl]amino]propanamide CAS Name: N-[(5-bromo-2-prop-2-ynoxyphenyl)methylideneamino]-2-[[2-(4-methoxyphenyl)-1-oxoethyl]amino]propanamide IUPAC Name: N-[(5-bromo-2-prop-2-ynoxyphenyl)methylideneamino]-2-[[2-(4-methoxyphenyl)acetyl]amino]propanamide Traditional Name: N-[(5-bromo-2-propargyloxy-benzylidene)amino]-2-[[2-(4-methoxyphenyl)acetyl]amino]propionamide Formula: C22H22BrN3O4 MolecularWeight: 472.33178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22BrN3O4/c1-4-11-30-20-10-7-18(23)13-17(20)14-24-26-22(28)15(2)25-21(27)12-16-5-8-19(29-3)9-6-16/h1,5-10,13-15H,11-12H2,2-3H3,(H,25,27)(H,26,28)