diethyl 2-[[4-(3-acetyloxypropylamino)phenyl]carbonylamino]pentanedioate

Systemtic Name: diethyl 2-[[4-(3-acetyloxypropylamino)phenyl]carbonylamino]pentanedioate Openeye Name: diethyl 2-[[4-(3-acetoxypropylamino)benzoyl]amino]pentanedioate CAS Name: 2-[[[4-(3-acetyloxypropylamino)phenyl]-oxomethyl]amino]pentanedioic acid diethyl ester IUPAC Name: diethyl 2-[[4-(3-acetyloxypropylamino)benzoyl]amino]pentanedioate Traditional Name: 2-[[4-(3-acetoxypropylamino)benzoyl]amino]glutaric acid diethyl ester Formula: C21H30N2O7 MolecularWeight: 422.4721

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C(=O)OCC)NC(=O)C1=CC=C(C=C1)NCCCOC(=O)C

Isomeric SMILES

CCOC(=O)CCC(C(=O)OCC)NC(=O)C1=CC=C(C=C1)NCCCOC(=O)C

InChI

InChI=1S/C21H30N2O7/c1-4-28-19(25)12-11-18(21(27)29-5-2)23-20(26)16-7-9-17(10-8-16)22-13-6-14-30-15(3)24/h7-10,18,22H,4-6,11-14H2,1-3H3,(H,23,26)