ethanedioic acid; [4-(2-ethoxyphenyl)piperazin-1-yl]-piperidin-4-yl-methanone

Systemtic Name: ethanedioic acid; [4-(2-ethoxyphenyl)piperazin-1-yl]-piperidin-4-yl-methanone Openeye Name: [4-(2-ethoxyphenyl)piperazin-1-yl]-(4-piperidyl)methanone; oxalic acid CAS Name: [4-(2-ethoxyphenyl)-1-piperazinyl]-(4-piperidinyl)methanone; oxalic acid IUPAC Name: [4-(2-ethoxyphenyl)piperazin-1-yl]-piperidin-4-ylmethanone; oxalic acid Traditional Name: (4-o-phenetylpiperazino)-(4-piperidyl)methanone; oxalic acid Formula: C20H29N3O6 MolecularWeight: 407.46076

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)C3CCNCC3.C(=O)(C(=O)O)O

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)C3CCNCC3.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H27N3O2.C2H2O4/c1-2-23-17-6-4-3-5-16(17)20-11-13-21(14-12-20)18(22)15-7-9-19-10-8-15;3-1(4)2(5)6/h3-6,15,19H,2,7-14H2,1H3;(H,3,4)(H,5,6)