(E)-3-[6-methoxy-7-(methoxymethoxy)-1-(phenylmethyl)indol-4-yl]-2-methyl-prop-2-enoic acid

Systemtic Name: (E)-3-[6-methoxy-7-(methoxymethoxy)-1-(phenylmethyl)indol-4-yl]-2-methyl-prop-2-enoic acid Openeye Name: (E)-3-[1-benzyl-6-methoxy-7-(methoxymethoxy)indol-4-yl]-2-methyl-prop-2-enoic acid CAS Name: (E)-3-[6-methoxy-7-(methoxymethoxy)-1-(phenylmethyl)-4-indolyl]-2-methyl-2-propenoic acid IUPAC Name: (E)-3-[1-benzyl-6-methoxy-7-(methoxymethoxy)indol-4-yl]-2-methylprop-2-enoic acid Traditional Name: (E)-3-[1-benzyl-6-methoxy-7-(methoxymethoxy)indol-4-yl]-2-methyl-acrylic acid Formula: C22H23NO5 MolecularWeight: 381.42172

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC(=C(C2=C1C=CN2CC3=CC=CC=C3)OCOC)OC)C(=O)O

Isomeric SMILES

C/C(=C\C1=CC(=C(C2=C1C=CN2CC3=CC=CC=C3)OCOC)OC)/C(=O)O

InChI

InChI=1S/C22H23NO5/c1-15(22(24)25)11-17-12-19(27-3)21(28-14-26-2)20-18(17)9-10-23(20)13-16-7-5-4-6-8-16/h4-12H,13-14H2,1-3H3,(H,24,25)/b15-11+