2-[[5-(3,4-dimethoxyphenyl)-2-methyl-furan-3-yl]carbonylamino]-3-(1H-indol-2-yl)propanoic acid

Systemtic Name: 2-[[5-(3,4-dimethoxyphenyl)-2-methyl-furan-3-yl]carbonylamino]-3-(1H-indol-2-yl)propanoic acid Openeye Name: 2-[[5-(3,4-dimethoxyphenyl)-2-methyl-furan-3-carbonyl]amino]-3-(1H-indol-2-yl)propanoic acid CAS Name: 2-[[[5-(3,4-dimethoxyphenyl)-2-methyl-3-furanyl]-oxomethyl]amino]-3-(1H-indol-2-yl)propanoic acid IUPAC Name: 2-[[5-(3,4-dimethoxyphenyl)-2-methylfuran-3-carbonyl]amino]-3-(1H-indol-2-yl)propanoic acid Traditional Name: 2-[[5-(3,4-dimethoxyphenyl)-2-methyl-3-furoyl]amino]-3-(1H-indol-2-yl)propionic acid Formula: C25H24N2O6 MolecularWeight: 448.46786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C2=CC(=C(C=C2)OC)OC)C(=O)NC(CC3=CC4=CC=CC=C4N3)C(=O)O

Isomeric SMILES

CC1=C(C=C(O1)C2=CC(=C(C=C2)OC)OC)C(=O)NC(CC3=CC4=CC=CC=C4N3)C(=O)O

InChI

InChI=1S/C25H24N2O6/c1-14-18(13-22(33-14)16-8-9-21(31-2)23(11-16)32-3)24(28)27-20(25(29)30)12-17-10-15-6-4-5-7-19(15)26-17/h4-11,13,20,26H,12H2,1-3H3,(H,27,28)(H,29,30)