diethyl 2-butyl-2-[3-[(2-chlorophenyl)amino]-3-oxidanylidene-propyl]propanedioate

Systemtic Name: diethyl 2-butyl-2-[3-[(2-chlorophenyl)amino]-3-oxidanylidene-propyl]propanedioate Openeye Name: diethyl 2-butyl-2-[3-(2-chloroanilino)-3-oxo-propyl]propanedioate CAS Name: 2-butyl-2-[3-(2-chloroanilino)-3-oxopropyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-butyl-2-[3-(2-chloroanilino)-3-oxopropyl]propanedioate Traditional Name: 2-butyl-2-[3-(2-chloroanilino)-3-keto-propyl]malonic acid diethyl ester Formula: C20H28ClNO5 MolecularWeight: 397.89302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCC(=O)NC1=CC=CC=C1Cl)(C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCCCC(CCC(=O)NC1=CC=CC=C1Cl)(C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C20H28ClNO5/c1-4-7-13-20(18(24)26-5-2,19(25)27-6-3)14-12-17(23)22-16-11-9-8-10-15(16)21/h8-11H,4-7,12-14H2,1-3H3,(H,22,23)