2-[2-[5-(3-chlorophenyl)furan-2-yl]ethyl-methoxycarbonyl-amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[2-[5-(3-chlorophenyl)furan-2-yl]ethyl-methoxycarbonyl-amino]-4-methyl-pentanoic acid Openeye Name: 2-[2-[5-(3-chlorophenyl)-2-furyl]ethyl-methoxycarbonyl-amino]-4-methyl-pentanoic acid CAS Name: 2-[2-[5-(3-chlorophenyl)-2-furanyl]ethyl-methoxycarbonylamino]-4-methylpentanoic acid IUPAC Name: 2-[2-[5-(3-chlorophenyl)furan-2-yl]ethyl-methoxycarbonylamino]-4-methylpentanoic acid Traditional Name: 2-[carbomethoxy-[2-[5-(3-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(=CC=C2)Cl)C(=O)OC

Isomeric SMILES

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

InChI

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