diethyl 2-[3-[(2-aminophenyl)-methyl-amino]-3-oxidanylidene-propyl]-2-(3-methylbut-2-enyl)propanedioate

Systemtic Name: diethyl 2-[3-[(2-aminophenyl)-methyl-amino]-3-oxidanylidene-propyl]-2-(3-methylbut-2-enyl)propanedioate Openeye Name: diethyl 2-[3-(2-amino-N-methyl-anilino)-3-oxo-propyl]-2-(3-methylbut-2-enyl)propanedioate CAS Name: 2-[3-(2-amino-N-methylanilino)-3-oxopropyl]-2-(3-methylbut-2-enyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-[3-(2-amino-N-methylanilino)-3-oxopropyl]-2-(3-methylbut-2-enyl)propanedioate Traditional Name: 2-[3-(2-amino-N-methyl-anilino)-3-keto-propyl]-2-(3-methylbut-2-enyl)malonic acid diethyl ester Formula: C22H32N2O5 MolecularWeight: 404.49988

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC(=O)N(C)C1=CC=CC=C1N)(CC=C(C)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CCC(=O)N(C)C1=CC=CC=C1N)(CC=C(C)C)C(=O)OCC

InChI

InChI=1S/C22H32N2O5/c1-6-28-20(26)22(14-12-16(3)4,21(27)29-7-2)15-13-19(25)24(5)18-11-9-8-10-17(18)23/h8-12H,6-7,13-15,23H2,1-5H3