ethanedioic acid; 1-[(4-ethylphenyl)methyl]-4-propan-2-yl-piperazine

Systemtic Name: ethanedioic acid; 1-[(4-ethylphenyl)methyl]-4-propan-2-yl-piperazine Openeye Name: 1-[(4-ethylphenyl)methyl]-4-isopropyl-piperazine; oxalic acid CAS Name: 1-[(4-ethylphenyl)methyl]-4-propan-2-ylpiperazine; oxalic acid IUPAC Name: 1-[(4-ethylphenyl)methyl]-4-propan-2-ylpiperazine; oxalic acid Traditional Name: 1-(4-ethylbenzyl)-4-isopropyl-piperazine; oxalic acid Formula: C18H28N2O4 MolecularWeight: 336.42592

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2CCN(CC2)C(C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCC1=CC=C(C=C1)CN2CCN(CC2)C(C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H26N2.C2H2O4/c1-4-15-5-7-16(8-6-15)13-17-9-11-18(12-10-17)14(2)3;3-1(4)2(5)6/h5-8,14H,4,9-13H2,1-3H3;(H,3,4)(H,5,6)