(E)-4-[3-[(2-methoxy-4-methoxycarbonyl-phenyl)methyl]-1-methyl-indol-5-yl]but-3-enoic acid

Systemtic Name: (E)-4-[3-[(2-methoxy-4-methoxycarbonyl-phenyl)methyl]-1-methyl-indol-5-yl]but-3-enoic acid Openeye Name: (E)-4-[3-[(2-methoxy-4-methoxycarbonyl-phenyl)methyl]-1-methyl-indol-5-yl]but-3-enoic acid CAS Name: (E)-4-[3-[(2-methoxy-4-methoxycarbonylphenyl)methyl]-1-methyl-5-indolyl]-3-butenoic acid IUPAC Name: (E)-4-[3-[(2-methoxy-4-methoxycarbonylphenyl)methyl]-1-methylindol-5-yl]but-3-enoic acid Traditional Name: (E)-4-[3-(4-carbomethoxy-2-methoxy-benzyl)-1-methyl-indol-5-yl]but-3-enoic acid Formula: C23H23NO5 MolecularWeight: 393.43242

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C=CC(=C2)C=CCC(=O)O)CC3=C(C=C(C=C3)C(=O)OC)OC

Isomeric SMILES

CN1C=C(C2=C1C=CC(=C2)/C=C/CC(=O)O)CC3=C(C=C(C=C3)C(=O)OC)OC

InChI

InChI=1S/C23H23NO5/c1-24-14-18(12-16-8-9-17(23(27)29-3)13-21(16)28-2)19-11-15(7-10-20(19)24)5-4-6-22(25)26/h4-5,7-11,13-14H,6,12H2,1-3H3,(H,25,26)/b5-4+