(E)-3-[5-bromanyl-2-[2-oxidanylidene-2-[(phenylmethyl)amino]ethoxy]phenyl]prop-2-enoate

Systemtic Name: (E)-3-[5-bromanyl-2-[2-oxidanylidene-2-[(phenylmethyl)amino]ethoxy]phenyl]prop-2-enoate Openeye Name: (E)-3-[2-[2-(benzylamino)-2-oxo-ethoxy]-5-bromo-phenyl]prop-2-enoate CAS Name: (E)-3-[5-bromo-2-[2-oxo-2-[(phenylmethyl)amino]ethoxy]phenyl]-2-propenoate IUPAC Name: (E)-3-[2-[2-(benzylamino)-2-oxoethoxy]-5-bromophenyl]prop-2-enoate Traditional Name: (E)-3-[2-[2-(benzylamino)-2-keto-ethoxy]-5-bromo-phenyl]acrylate Formula: C18H15BrNO4- MolecularWeight: 389.22

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)COC2=C(C=C(C=C2)Br)C=CC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)COC2=C(C=C(C=C2)Br)/C=C/C(=O)[O-]

InChI

InChI=1S/C18H16BrNO4/c19-15-7-8-16(14(10-15)6-9-18(22)23)24-12-17(21)20-11-13-4-2-1-3-5-13/h1-10H,11-12H2,(H,20,21)(H,22,23)/p-1/b9-6+