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

Systemtic Name: (Z)-3-[4-[2-(5-bromanylindol-1-yl)ethoxy]phenyl]-2-ethoxy-prop-2-enoic acid Openeye Name: (Z)-3-[4-[2-(5-bromoindol-1-yl)ethoxy]phenyl]-2-ethoxy-prop-2-enoic acid CAS Name: (Z)-3-[4-[2-(5-bromo-1-indolyl)ethoxy]phenyl]-2-ethoxy-2-propenoic acid IUPAC Name: (Z)-3-[4-[2-(5-bromoindol-1-yl)ethoxy]phenyl]-2-ethoxyprop-2-enoic acid Traditional Name: (Z)-3-[4-[2-(5-bromoindol-1-yl)ethoxy]phenyl]-2-ethoxy-acrylic acid Formula: C21H20BrNO4 MolecularWeight: 430.2918

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=CC1=CC=C(C=C1)OCCN2C=CC3=C2C=CC(=C3)Br)C(=O)O

Isomeric SMILES

CCO/C(=C\C1=CC=C(C=C1)OCCN2C=CC3=C2C=CC(=C3)Br)/C(=O)O

InChI

InChI=1S/C21H20BrNO4/c1-2-26-20(21(24)25)13-15-3-6-18(7-4-15)27-12-11-23-10-9-16-14-17(22)5-8-19(16)23/h3-10,13-14H,2,11-12H2,1H3,(H,24,25)/b20-13-