4-(2-chloranylethanoylamino)-N-(2-diethylaminoethyl)benzamide; ethanedioate

Systemtic Name: 4-(2-chloranylethanoylamino)-N-(2-diethylaminoethyl)benzamide; ethanedioate Openeye Name: 4-[(2-chloroacetyl)amino]-N-(2-diethylaminoethyl)benzamide; oxalate CAS Name: 4-[(2-chloro-1-oxoethyl)amino]-N-(2-diethylaminoethyl)benzamide; oxalate IUPAC Name: 4-[(2-chloroacetyl)amino]-N-(2-diethylaminoethyl)benzamide; oxalate Traditional Name: 4-[(2-chloroacetyl)amino]-N-(2-diethylaminoethyl)benzamide; oxalate Formula: C17H22ClN3O6-2 MolecularWeight: 399.82608

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=O)CCl.C(=O)(C(=O)[O-])[O-]

Isomeric SMILES

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=O)CCl.C(=O)(C(=O)[O-])[O-]

InChI

InChI=1S/C15H22ClN3O2.C2H2O4/c1-3-19(4-2)10-9-17-15(21)12-5-7-13(8-6-12)18-14(20)11-16;3-1(4)2(5)6/h5-8H,3-4,9-11H2,1-2H3,(H,17,21)(H,18,20);(H,3,4)(H,5,6)/p-2