diethyl 2-[[4,5-bis(dimethylamino)naphthalen-1-yl]methyl]propanedioate

Systemtic Name: diethyl 2-[[4,5-bis(dimethylamino)naphthalen-1-yl]methyl]propanedioate Openeye Name: diethyl 2-[[4,5-bis(dimethylamino)-1-naphthyl]methyl]propanedioate CAS Name: 2-[[4,5-bis(dimethylamino)-1-naphthalenyl]methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[4,5-bis(dimethylamino)naphthalen-1-yl]methyl]propanedioate Traditional Name: 2-[[4,5-bis(dimethylamino)-1-naphthyl]methyl]malonic acid diethyl ester Formula: C22H30N2O4 MolecularWeight: 386.4846

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=C2C=CC=C(C2=C(C=C1)N(C)C)N(C)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CC1=C2C=CC=C(C2=C(C=C1)N(C)C)N(C)C)C(=O)OCC

InChI

InChI=1S/C22H30N2O4/c1-7-27-21(25)17(22(26)28-8-2)14-15-12-13-19(24(5)6)20-16(15)10-9-11-18(20)23(3)4/h9-13,17H,7-8,14H2,1-6H3