butyl 4-[2-[methyl-(1-methylpiperidin-4-yl)amino]ethanoylamino]benzoate; ethanedioic acid

Systemtic Name: butyl 4-[2-[methyl-(1-methylpiperidin-4-yl)amino]ethanoylamino]benzoate; ethanedioic acid Openeye Name: butyl 4-[[2-[methyl-(1-methyl-4-piperidyl)amino]acetyl]amino]benzoate; oxalic acid CAS Name: 4-[[2-[methyl-(1-methyl-4-piperidinyl)amino]-1-oxoethyl]amino]benzoic acid butyl ester; oxalic acid IUPAC Name: butyl 4-[[2-[methyl-(1-methylpiperidin-4-yl)amino]acetyl]amino]benzoate; oxalic acid Traditional Name: 4-[[2-[methyl-(1-methyl-4-piperidyl)amino]acetyl]amino]benzoic acid butyl ester; oxalic acid Formula: C22H33N3O7 MolecularWeight: 451.51332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CN(C)C2CCN(CC2)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CN(C)C2CCN(CC2)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H31N3O3.C2H2O4/c1-4-5-14-26-20(25)16-6-8-17(9-7-16)21-19(24)15-23(3)18-10-12-22(2)13-11-18;3-1(4)2(5)6/h6-9,18H,4-5,10-15H2,1-3H3,(H,21,24);(H,3,4)(H,5,6)