dipropan-2-yl 2-(2-azanyl-4-methanoyl-3-methyl-phenyl)propanedioate

Systemtic Name: dipropan-2-yl 2-(2-azanyl-4-methanoyl-3-methyl-phenyl)propanedioate Openeye Name: diisopropyl 2-(2-amino-4-formyl-3-methyl-phenyl)propanedioate CAS Name: 2-(2-amino-4-formyl-3-methylphenyl)propanedioic acid dipropan-2-yl ester IUPAC Name: dipropan-2-yl 2-(2-amino-4-formyl-3-methylphenyl)propanedioate Traditional Name: 2-(2-amino-4-formyl-3-methyl-phenyl)malonic acid diisopropyl ester Formula: C17H23NO5 MolecularWeight: 321.36822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1N)C(C(=O)OC(C)C)C(=O)OC(C)C)C=O

Isomeric SMILES

CC1=C(C=CC(=C1N)C(C(=O)OC(C)C)C(=O)OC(C)C)C=O

InChI

InChI=1S/C17H23NO5/c1-9(2)22-16(20)14(17(21)23-10(3)4)13-7-6-12(8-19)11(5)15(13)18/h6-10,14H,18H2,1-5H3