ethanedioic acid; 2-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: ethanedioic acid; 2-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone; oxalic acid CAS Name: 2-[4-[(4-methoxyphenyl)methyl]-1-piperazinyl]-1-(1-pyrrolidinyl)ethanone; oxalic acid IUPAC Name: 2-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-1-pyrrolidin-1-ylethanone; oxalic acid Traditional Name: oxalic acid; 2-(4-p-anisylpiperazino)-1-pyrrolidino-ethanone Formula: C20H29N3O6 MolecularWeight: 407.46076

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CCN(CC2)CC(=O)N3CCCC3.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=C(C=C1)CN2CCN(CC2)CC(=O)N3CCCC3.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H27N3O2.C2H2O4/c1-23-17-6-4-16(5-7-17)14-19-10-12-20(13-11-19)15-18(22)21-8-2-3-9-21;3-1(4)2(5)6/h4-7H,2-3,8-15H2,1H3;(H,3,4)(H,5,6)