2-[2-[(1,5-dimethylindol-2-yl)carbonylamino]propanoylamino]-3-methyl-pentanoic acid

Systemtic Name: 2-[2-[(1,5-dimethylindol-2-yl)carbonylamino]propanoylamino]-3-methyl-pentanoic acid Openeye Name: 2-[2-[(1,5-dimethylindole-2-carbonyl)amino]propanoylamino]-3-methyl-pentanoic acid CAS Name: 2-[[2-[[(1,5-dimethyl-2-indolyl)-oxomethyl]amino]-1-oxopropyl]amino]-3-methylpentanoic acid IUPAC Name: 2-[2-[(1,5-dimethylindole-2-carbonyl)amino]propanoylamino]-3-methylpentanoic acid Traditional Name: 2-[2-[(1,5-dimethylindole-2-carbonyl)amino]propanoylamino]-3-methyl-valeric acid Formula: C20H27N3O4 MolecularWeight: 373.44608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)C(C)NC(=O)C1=CC2=C(N1C)C=CC(=C2)C

Isomeric SMILES

CCC(C)C(C(=O)O)NC(=O)C(C)NC(=O)C1=CC2=C(N1C)C=CC(=C2)C

InChI

InChI=1S/C20H27N3O4/c1-6-12(3)17(20(26)27)22-18(24)13(4)21-19(25)16-10-14-9-11(2)7-8-15(14)23(16)5/h7-10,12-13,17H,6H2,1-5H3,(H,21,25)(H,22,24)(H,26,27)