ethanedioic acid; 1-(4-imidazol-1-ylphenyl)-N-[(4-piperidin-1-ylphenyl)methyl]ethanamine

Systemtic Name: ethanedioic acid; 1-(4-imidazol-1-ylphenyl)-N-[(4-piperidin-1-ylphenyl)methyl]ethanamine Openeye Name: 1-(4-imidazol-1-ylphenyl)-N-[[4-(1-piperidyl)phenyl]methyl]ethanamine; oxalic acid CAS Name: 1-[4-(1-imidazolyl)phenyl]-N-[[4-(1-piperidinyl)phenyl]methyl]ethanamine; oxalic acid IUPAC Name: 1-(4-imidazol-1-ylphenyl)-N-[(4-piperidin-1-ylphenyl)methyl]ethanamine; oxalic acid Traditional Name: 1-(4-imidazol-1-ylphenyl)ethyl-(4-piperidinobenzyl)amine; oxalic acid Formula: C25H30N4O4 MolecularWeight: 450.5301

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=CN=C2)NCC3=CC=C(C=C3)N4CCCCC4.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C1=CC=C(C=C1)N2C=CN=C2)NCC3=CC=C(C=C3)N4CCCCC4.C(=O)(C(=O)O)O

InChI

InChI=1S/C23H28N4.C2H2O4/c1-19(21-7-11-23(12-8-21)27-16-13-24-18-27)25-17-20-5-9-22(10-6-20)26-14-3-2-4-15-26;3-1(4)2(5)6/h5-13,16,18-19,25H,2-4,14-15,17H2,1H3;(H,3,4)(H,5,6)