3-[furan-2-ylcarbonyl-[2-[3-methylbutyl-(2-oxidanylidene-2-phenylazanyl-ethyl)amino]-2-oxidanylidene-ethyl]amino]propanoic acid

Systemtic Name: 3-[furan-2-ylcarbonyl-[2-[3-methylbutyl-(2-oxidanylidene-2-phenylazanyl-ethyl)amino]-2-oxidanylidene-ethyl]amino]propanoic acid Openeye Name: 3-[[2-[(2-anilino-2-oxo-ethyl)-isopentyl-amino]-2-oxo-ethyl]-(furan-2-carbonyl)amino]propanoic acid CAS Name: 3-[[2-[(2-anilino-2-oxoethyl)-(3-methylbutyl)amino]-2-oxoethyl]-[2-furanyl(oxo)methyl]amino]propanoic acid IUPAC Name: 3-[[2-[(2-anilino-2-oxoethyl)-(3-methylbutyl)amino]-2-oxoethyl]-(furan-2-carbonyl)amino]propanoic acid Traditional Name: 3-[[2-[(2-anilino-2-keto-ethyl)-isoamyl-amino]-2-keto-ethyl]-(2-furoyl)amino]propionic acid Formula: C23H29N3O6 MolecularWeight: 443.49286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(CC(=O)NC1=CC=CC=C1)C(=O)CN(CCC(=O)O)C(=O)C2=CC=CO2

Isomeric SMILES

CC(C)CCN(CC(=O)NC1=CC=CC=C1)C(=O)CN(CCC(=O)O)C(=O)C2=CC=CO2

InChI

InChI=1S/C23H29N3O6/c1-17(2)10-12-25(15-20(27)24-18-7-4-3-5-8-18)21(28)16-26(13-11-22(29)30)23(31)19-9-6-14-32-19/h3-9,14,17H,10-13,15-16H2,1-2H3,(H,24,27)(H,29,30)