O4-tert-butyl O1-methyl 2-[2-[(3,4-dichlorophenyl)amino]propanoylamino]butanedioate

Systemtic Name: O4-tert-butyl O1-methyl 2-[2-[(3,4-dichlorophenyl)amino]propanoylamino]butanedioate Openeye Name: O4-tert-butyl O1-methyl 2-[2-(3,4-dichloroanilino)propanoylamino]butanedioate CAS Name: 2-[[2-(3,4-dichloroanilino)-1-oxopropyl]amino]butanedioic acid O4-tert-butyl ester O1-methyl ester IUPAC Name: 4-O-tert-butyl 1-O-methyl 2-[2-(3,4-dichloroanilino)propanoylamino]butanedioate Traditional Name: 2-[2-(3,4-dichloroanilino)propanoylamino]succinic acid O4-tert-butyl ester O1-methyl ester Formula: C18H24Cl2N2O5 MolecularWeight: 419.29956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CC(=O)OC(C)(C)C)C(=O)OC)NC1=CC(=C(C=C1)Cl)Cl

Isomeric SMILES

CC(C(=O)NC(CC(=O)OC(C)(C)C)C(=O)OC)NC1=CC(=C(C=C1)Cl)Cl

InChI

InChI=1S/C18H24Cl2N2O5/c1-10(21-11-6-7-12(19)13(20)8-11)16(24)22-14(17(25)26-5)9-15(23)27-18(2,3)4/h6-8,10,14,21H,9H2,1-5H3,(H,22,24)