diethyl 2-[3-[1-(2-methylcyclopropyl)butylamino]phenyl]carbonylpropanedioate

Systemtic Name: diethyl 2-[3-[1-(2-methylcyclopropyl)butylamino]phenyl]carbonylpropanedioate Openeye Name: diethyl 2-[3-[1-(2-methylcyclopropyl)butylamino]benzoyl]propanedioate CAS Name: 2-[[3-[1-(2-methylcyclopropyl)butylamino]phenyl]-oxomethyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[3-[1-(2-methylcyclopropyl)butylamino]benzoyl]propanedioate Traditional Name: 2-[3-[1-(2-methylcyclopropyl)butylamino]benzoyl]malonic acid diethyl ester Formula: C22H31NO5 MolecularWeight: 389.48524

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1CC1C)NC2=CC=CC(=C2)C(=O)C(C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCCC(C1CC1C)NC2=CC=CC(=C2)C(=O)C(C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C22H31NO5/c1-5-9-18(17-12-14(17)4)23-16-11-8-10-15(13-16)20(24)19(21(25)27-6-2)22(26)28-7-3/h8,10-11,13-14,17-19,23H,5-7,9,12H2,1-4H3