2-[[2-[(1,5-dimethylindol-2-yl)carbonylamino]-4-methyl-pentanoyl]amino]propanoic acid

Systemtic Name: 2-[[2-[(1,5-dimethylindol-2-yl)carbonylamino]-4-methyl-pentanoyl]amino]propanoic acid Openeye Name: 2-[[2-[(1,5-dimethylindole-2-carbonyl)amino]-4-methyl-pentanoyl]amino]propanoic acid CAS Name: 2-[[2-[[(1,5-dimethyl-2-indolyl)-oxomethyl]amino]-4-methyl-1-oxopentyl]amino]propanoic acid IUPAC Name: 2-[[2-[(1,5-dimethylindole-2-carbonyl)amino]-4-methylpentanoyl]amino]propanoic acid Traditional Name: 2-[[2-[(1,5-dimethylindole-2-carbonyl)amino]-4-methyl-pentanoyl]amino]propionic acid Formula: C20H27N3O4 MolecularWeight: 373.44608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=C2)C(=O)NC(CC(C)C)C(=O)NC(C)C(=O)O)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=C2)C(=O)NC(CC(C)C)C(=O)NC(C)C(=O)O)C

InChI

InChI=1S/C20H27N3O4/c1-11(2)8-15(18(24)21-13(4)20(26)27)22-19(25)17-10-14-9-12(3)6-7-16(14)23(17)5/h6-7,9-11,13,15H,8H2,1-5H3,(H,21,24)(H,22,25)(H,26,27)