2-[[2-[(5,6-dimethoxy-1-methyl-indol-2-yl)carbonylamino]-3-methyl-butanoyl]amino]propanoic acid

Systemtic Name: 2-[[2-[(5,6-dimethoxy-1-methyl-indol-2-yl)carbonylamino]-3-methyl-butanoyl]amino]propanoic acid Openeye Name: 2-[[2-[(5,6-dimethoxy-1-methyl-indole-2-carbonyl)amino]-3-methyl-butanoyl]amino]propanoic acid CAS Name: 2-[[2-[[(5,6-dimethoxy-1-methyl-2-indolyl)-oxomethyl]amino]-3-methyl-1-oxobutyl]amino]propanoic acid IUPAC Name: 2-[[2-[(5,6-dimethoxy-1-methylindole-2-carbonyl)amino]-3-methylbutanoyl]amino]propanoic acid Traditional Name: 2-[[2-[(5,6-dimethoxy-1-methyl-indole-2-carbonyl)amino]-3-methyl-butanoyl]amino]propionic acid Formula: C20H27N3O6 MolecularWeight: 405.44488

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(C)C(=O)O)NC(=O)C1=CC2=CC(=C(C=C2N1C)OC)OC

Isomeric SMILES

CC(C)C(C(=O)NC(C)C(=O)O)NC(=O)C1=CC2=CC(=C(C=C2N1C)OC)OC

InChI

InChI=1S/C20H27N3O6/c1-10(2)17(19(25)21-11(3)20(26)27)22-18(24)14-7-12-8-15(28-5)16(29-6)9-13(12)23(14)4/h7-11,17H,1-6H3,(H,21,25)(H,22,24)(H,26,27)