2-[2-chloranylbutanoyl-[(2,4-dimethoxyphenyl)methyl]amino]-2-ethyl-propanedioic acid

Systemtic Name: 2-[2-chloranylbutanoyl-[(2,4-dimethoxyphenyl)methyl]amino]-2-ethyl-propanedioic acid Openeye Name: 2-[2-chlorobutanoyl-[(2,4-dimethoxyphenyl)methyl]amino]-2-ethyl-propanedioic acid CAS Name: 2-[(2-chloro-1-oxobutyl)-[(2,4-dimethoxyphenyl)methyl]amino]-2-ethylpropanedioic acid IUPAC Name: 2-[2-chlorobutanoyl-[(2,4-dimethoxyphenyl)methyl]amino]-2-ethylpropanedioic acid Traditional Name: 2-[2-chlorobutanoyl-(2,4-dimethoxybenzyl)amino]-2-ethyl-malonic acid Formula: C18H24ClNO7 MolecularWeight: 401.83866

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N(CC1=C(C=C(C=C1)OC)OC)C(CC)(C(=O)O)C(=O)O)Cl

Isomeric SMILES

CCC(C(=O)N(CC1=C(C=C(C=C1)OC)OC)C(CC)(C(=O)O)C(=O)O)Cl

InChI

InChI=1S/C18H24ClNO7/c1-5-13(19)15(21)20(18(6-2,16(22)23)17(24)25)10-11-7-8-12(26-3)9-14(11)27-4/h7-9,13H,5-6,10H2,1-4H3,(H,22,23)(H,24,25)