3-(1H-indol-3-yl)-2-[[4-methyl-2-(oxidanylcarbamoyl)pentanoyl]amino]propanoic acid

Systemtic Name: 3-(1H-indol-3-yl)-2-[[4-methyl-2-(oxidanylcarbamoyl)pentanoyl]amino]propanoic acid Openeye Name: 2-[[2-(hydroxycarbamoyl)-4-methyl-pentanoyl]amino]-3-(1H-indol-3-yl)propanoic acid CAS Name: 2-[[2-[(hydroxyamino)-oxomethyl]-4-methyl-1-oxopentyl]amino]-3-(1H-indol-3-yl)propanoic acid IUPAC Name: 2-[[2-(hydroxycarbamoyl)-4-methylpentanoyl]amino]-3-(1H-indol-3-yl)propanoic acid Traditional Name: 2-[[2-(hydroxycarbamoyl)-4-methyl-pentanoyl]amino]-3-(1H-indol-3-yl)propionic acid Formula: C18H23N3O5 MolecularWeight: 361.39232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)O)C(=O)NO

Isomeric SMILES

CC(C)CC(C(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)O)C(=O)NO

InChI

InChI=1S/C18H23N3O5/c1-10(2)7-13(17(23)21-26)16(22)20-15(18(24)25)8-11-9-19-14-6-4-3-5-12(11)14/h3-6,9-10,13,15,19,26H,7-8H2,1-2H3,(H,20,22)(H,21,23)(H,24,25)