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

Systemtic Name: (Z)-3-[4-[2-(5-cyanoindol-1-yl)ethoxy]-3-methoxy-phenyl]-2-methoxy-prop-2-enoic acid Openeye Name: (Z)-3-[4-[2-(5-cyanoindol-1-yl)ethoxy]-3-methoxy-phenyl]-2-methoxy-prop-2-enoic acid CAS Name: (Z)-3-[4-[2-(5-cyano-1-indolyl)ethoxy]-3-methoxyphenyl]-2-methoxy-2-propenoic acid IUPAC Name: (Z)-3-[4-[2-(5-cyanoindol-1-yl)ethoxy]-3-methoxyphenyl]-2-methoxyprop-2-enoic acid Traditional Name: (Z)-3-[4-[2-(5-cyanoindol-1-yl)ethoxy]-3-methoxy-phenyl]-2-methoxy-acrylic acid Formula: C22H20N2O5 MolecularWeight: 392.4046

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C(=O)O)OC)OCCN2C=CC3=C2C=CC(=C3)C#N

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(/C(=O)O)\OC)OCCN2C=CC3=C2C=CC(=C3)C#N

InChI

InChI=1S/C22H20N2O5/c1-27-20-12-15(13-21(28-2)22(25)26)4-6-19(20)29-10-9-24-8-7-17-11-16(14-23)3-5-18(17)24/h3-8,11-13H,9-10H2,1-2H3,(H,25,26)/b21-13-