N-[(E)-(5-bromanyl-2-prop-2-ynoxy-phenyl)methylideneamino]-2-(4-pentoxyphenoxy)propanamide

Systemtic Name: N-[(E)-(5-bromanyl-2-prop-2-ynoxy-phenyl)methylideneamino]-2-(4-pentoxyphenoxy)propanamide Openeye Name: N-[(E)-(5-bromo-2-prop-2-ynoxy-phenyl)methyleneamino]-2-(4-pentoxyphenoxy)propanamide CAS Name: N-[(E)-(5-bromo-2-prop-2-ynoxyphenyl)methylideneamino]-2-(4-pentoxyphenoxy)propanamide IUPAC Name: N-[(E)-(5-bromo-2-prop-2-ynoxyphenyl)methylideneamino]-2-(4-pentoxyphenoxy)propanamide Traditional Name: 2-(4-amoxyphenoxy)-N-[(E)-(5-bromo-2-propargyloxy-benzylidene)amino]propionamide Formula: C24H27BrN2O4 MolecularWeight: 487.38618

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)OC(C)C(=O)NN=CC2=C(C=CC(=C2)Br)OCC#C

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)OC(C)C(=O)N/N=C/C2=C(C=CC(=C2)Br)OCC#C

InChI

InChI=1S/C24H27BrN2O4/c1-4-6-7-15-29-21-9-11-22(12-10-21)31-18(3)24(28)27-26-17-19-16-20(25)8-13-23(19)30-14-5-2/h2,8-13,16-18H,4,6-7,14-15H2,1,3H3,(H,27,28)/b26-17+