N-[(E)-1-[4-(2-bromanylphenoxy)phenyl]-3-oxidanylidene-3-(pyridin-3-ylamino)prop-1-en-2-yl]benzamide

Systemtic Name: N-[(E)-1-[4-(2-bromanylphenoxy)phenyl]-3-oxidanylidene-3-(pyridin-3-ylamino)prop-1-en-2-yl]benzamide Openeye Name: N-[(E)-2-[4-(2-bromophenoxy)phenyl]-1-(3-pyridylcarbamoyl)vinyl]benzamide CAS Name: N-[(E)-1-[4-(2-bromophenoxy)phenyl]-3-oxo-3-(3-pyridinylamino)prop-1-en-2-yl]benzamide IUPAC Name: N-[(E)-1-[4-(2-bromophenoxy)phenyl]-3-oxo-3-(pyridin-3-ylamino)prop-1-en-2-yl]benzamide Traditional Name: N-[(E)-2-[4-(2-bromophenoxy)phenyl]-1-(3-pyridylcarbamoyl)vinyl]benzamide Formula: C27H20BrN3O3 MolecularWeight: 514.37

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(=CC2=CC=C(C=C2)OC3=CC=CC=C3Br)C(=O)NC4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N/C(=C/C2=CC=C(C=C2)OC3=CC=CC=C3Br)/C(=O)NC4=CN=CC=C4

InChI

InChI=1S/C27H20BrN3O3/c28-23-10-4-5-11-25(23)34-22-14-12-19(13-15-22)17-24(27(33)30-21-9-6-16-29-18-21)31-26(32)20-7-2-1-3-8-20/h1-18H,(H,30,33)(H,31,32)/b24-17+