ethanedioic acid; 3-(4-methylpiperazin-1-yl)-N-[(2-phenyl-1H-indol-3-yl)methyl]propan-1-amine

Systemtic Name: ethanedioic acid; 3-(4-methylpiperazin-1-yl)-N-[(2-phenyl-1H-indol-3-yl)methyl]propan-1-amine Openeye Name: 3-(4-methylpiperazin-1-yl)-N-[(2-phenyl-1H-indol-3-yl)methyl]propan-1-amine; oxalic acid CAS Name: 3-(4-methyl-1-piperazinyl)-N-[(2-phenyl-1H-indol-3-yl)methyl]-1-propanamine; oxalic acid IUPAC Name: 3-(4-methylpiperazin-1-yl)-N-[(2-phenyl-1H-indol-3-yl)methyl]propan-1-amine; oxalic acid Traditional Name: 3-(4-methylpiperazino)propyl-[(2-phenyl-1H-indol-3-yl)methyl]amine; oxalic acid Formula: C25H32N4O4 MolecularWeight: 452.54598

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCNCC2=C(NC3=CC=CC=C32)C4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

CN1CCN(CC1)CCCNCC2=C(NC3=CC=CC=C32)C4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C23H30N4.C2H2O4/c1-26-14-16-27(17-15-26)13-7-12-24-18-21-20-10-5-6-11-22(20)25-23(21)19-8-3-2-4-9-19;3-1(4)2(5)6/h2-6,8-11,24-25H,7,12-18H2,1H3;(H,3,4)(H,5,6)