3-[1-(2-azanyl-4-methyl-pentanoyl)indol-3-yl]-2-(furan-2-ylcarbonylamino)propanoic acid

Systemtic Name: 3-[1-(2-azanyl-4-methyl-pentanoyl)indol-3-yl]-2-(furan-2-ylcarbonylamino)propanoic acid Openeye Name: 3-[1-(2-amino-4-methyl-pentanoyl)indol-3-yl]-2-(furan-2-carbonylamino)propanoic acid CAS Name: 3-[1-(2-amino-4-methyl-1-oxopentyl)-3-indolyl]-2-[[2-furanyl(oxo)methyl]amino]propanoic acid IUPAC Name: 3-[1-(2-amino-4-methylpentanoyl)indol-3-yl]-2-(furan-2-carbonylamino)propanoic acid Traditional Name: 3-[1-(2-amino-4-methyl-pentanoyl)indol-3-yl]-2-(2-furoylamino)propionic acid Formula: C22H23N3O5 MolecularWeight: 409.43512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N1C=C(C2=CC=CC=C21)[CH][C](C(=O)O)NC(=O)C3=CC=CO3)N

Isomeric SMILES

CC(C)CC(C(=O)N1C=C(C2=CC=CC=C21)[CH][C](C(=O)O)NC(=O)C3=CC=CO3)N

InChI

InChI=1S/C22H23N3O5/c1-13(2)10-16(23)21(27)25-12-14(15-6-3-4-7-18(15)25)11-17(22(28)29)24-20(26)19-8-5-9-30-19/h3-9,11-13,16H,10,23H2,1-2H3,(H,24,26)(H,28,29)