2-(1,3-benzoxazol-2-yl)-4-[[(E)-3-(5-bromanyl-2-methoxy-phenyl)prop-2-enoyl]amino]phenolate

Systemtic Name: 2-(1,3-benzoxazol-2-yl)-4-[[(E)-3-(5-bromanyl-2-methoxy-phenyl)prop-2-enoyl]amino]phenolate Openeye Name: 2-(1,3-benzoxazol-2-yl)-4-[[(E)-3-(5-bromo-2-methoxy-phenyl)prop-2-enoyl]amino]phenolate CAS Name: 2-(1,3-benzoxazol-2-yl)-4-[[(E)-3-(5-bromo-2-methoxyphenyl)-1-oxoprop-2-enyl]amino]phenolate IUPAC Name: 2-(1,3-benzoxazol-2-yl)-4-[[(E)-3-(5-bromo-2-methoxyphenyl)prop-2-enoyl]amino]phenolate Traditional Name: 2-(1,3-benzoxazol-2-yl)-4-[[(E)-3-(5-bromo-2-methoxy-phenyl)acryloyl]amino]phenolate Formula: C23H16BrN2O4- MolecularWeight: 464.28814

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C=CC(=O)NC2=CC(=C(C=C2)[O-])C3=NC4=CC=CC=C4O3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)/C=C/C(=O)NC2=CC(=C(C=C2)[O-])C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C23H17BrN2O4/c1-29-20-10-7-15(24)12-14(20)6-11-22(28)25-16-8-9-19(27)17(13-16)23-26-18-4-2-3-5-21(18)30-23/h2-13,27H,1H3,(H,25,28)/p-1/b11-6+