ethanedioic acid; 1-(4-imidazol-1-ylphenyl)-N-[(6-methoxynaphthalen-2-yl)methyl]ethanamine

Systemtic Name: ethanedioic acid; 1-(4-imidazol-1-ylphenyl)-N-[(6-methoxynaphthalen-2-yl)methyl]ethanamine Openeye Name: 1-(4-imidazol-1-ylphenyl)-N-[(6-methoxy-2-naphthyl)methyl]ethanamine; oxalic acid CAS Name: 1-[4-(1-imidazolyl)phenyl]-N-[(6-methoxy-2-naphthalenyl)methyl]ethanamine; oxalic acid IUPAC Name: 1-(4-imidazol-1-ylphenyl)-N-[(6-methoxynaphthalen-2-yl)methyl]ethanamine; oxalic acid Traditional Name: 1-(4-imidazol-1-ylphenyl)ethyl-[(6-methoxy-2-naphthyl)methyl]amine; oxalic acid Formula: C25H25N3O5 MolecularWeight: 447.4831

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=CN=C2)NCC3=CC4=C(C=C3)C=C(C=C4)OC.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C1=CC=C(C=C1)N2C=CN=C2)NCC3=CC4=C(C=C3)C=C(C=C4)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C23H23N3O.C2H2O4/c1-17(19-5-8-22(9-6-19)26-12-11-24-16-26)25-15-18-3-4-21-14-23(27-2)10-7-20(21)13-18;3-1(4)2(5)6/h3-14,16-17,25H,15H2,1-2H3;(H,3,4)(H,5,6)