(Z)-3-[4-[2-(5-bromanylindol-1-yl)ethoxy]phenyl]-2-naphthalen-2-yloxy-prop-2-enoic acid

Systemtic Name: (Z)-3-[4-[2-(5-bromanylindol-1-yl)ethoxy]phenyl]-2-naphthalen-2-yloxy-prop-2-enoic acid Openeye Name: (Z)-3-[4-[2-(5-bromoindol-1-yl)ethoxy]phenyl]-2-(2-naphthyloxy)prop-2-enoic acid CAS Name: (Z)-3-[4-[2-(5-bromo-1-indolyl)ethoxy]phenyl]-2-(2-naphthalenyloxy)-2-propenoic acid IUPAC Name: (Z)-3-[4-[2-(5-bromoindol-1-yl)ethoxy]phenyl]-2-naphthalen-2-yloxyprop-2-enoic acid Traditional Name: (Z)-3-[4-[2-(5-bromoindol-1-yl)ethoxy]phenyl]-2-(2-naphthoxy)acrylic acid Formula: C29H22BrNO4 MolecularWeight: 528.39328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)OC(=CC3=CC=C(C=C3)OCCN4C=CC5=C4C=CC(=C5)Br)C(=O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)O/C(=C\C3=CC=C(C=C3)OCCN4C=CC5=C4C=CC(=C5)Br)/C(=O)O

InChI

InChI=1S/C29H22BrNO4/c30-24-8-12-27-23(18-24)13-14-31(27)15-16-34-25-9-5-20(6-10-25)17-28(29(32)33)35-26-11-7-21-3-1-2-4-22(21)19-26/h1-14,17-19H,15-16H2,(H,32,33)/b28-17-