2-[carboxy-[2-[5-(4-methylphenyl)furan-2-yl]ethyl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[carboxy-[2-[5-(4-methylphenyl)furan-2-yl]ethyl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[carboxy-[2-[5-(p-tolyl)-2-furyl]ethyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[carboxy-[2-[5-(4-methylphenyl)-2-furanyl]ethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[carboxy-[2-[5-(4-methylphenyl)furan-2-yl]ethyl]amino]-4-methylpentanoic acid Traditional Name: 2-[carboxy-[2-[5-(p-tolyl)-2-furyl]ethyl]amino]-4-methyl-valeric acid Formula: C20H25NO5 MolecularWeight: 359.4162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=C(O2)CCN(C(CC(C)C)C(=O)O)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=C(O2)CCN(C(CC(C)C)C(=O)O)C(=O)O

InChI

InChI=1S/C20H25NO5/c1-13(2)12-17(19(22)23)21(20(24)25)11-10-16-8-9-18(26-16)15-6-4-14(3)5-7-15/h4-9,13,17H,10-12H2,1-3H3,(H,22,23)(H,24,25)