2-[2-[5-(4-chlorophenyl)furan-2-yl]ethyl-methoxycarbonyl-amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[2-[5-(4-chlorophenyl)furan-2-yl]ethyl-methoxycarbonyl-amino]-4-methyl-pentanoic acid Openeye Name: 2-[2-[5-(4-chlorophenyl)-2-furyl]ethyl-methoxycarbonyl-amino]-4-methyl-pentanoic acid CAS Name: 2-[2-[5-(4-chlorophenyl)-2-furanyl]ethyl-methoxycarbonylamino]-4-methylpentanoic acid IUPAC Name: 2-[2-[5-(4-chlorophenyl)furan-2-yl]ethyl-methoxycarbonylamino]-4-methylpentanoic acid Traditional Name: 2-[carbomethoxy-[2-[5-(4-chlorophenyl)-2-furyl]ethyl]amino]-4-methyl-valeric acid Formula: C20H24ClNO5 MolecularWeight: 393.86126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)N(CCC1=CC=C(O1)C2=CC=C(C=C2)Cl)C(=O)OC

Isomeric SMILES

CC(C)CC(C(=O)O)N(CCC1=CC=C(O1)C2=CC=C(C=C2)Cl)C(=O)OC

InChI

InChI=1S/C20H24ClNO5/c1-13(2)12-17(19(23)24)22(20(25)26-3)11-10-16-8-9-18(27-16)14-4-6-15(21)7-5-14/h4-9,13,17H,10-12H2,1-3H3,(H,23,24)