ethanedioic acid; (4-methoxyphenyl)-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone

Systemtic Name: ethanedioic acid; (4-methoxyphenyl)-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone Openeye Name: (4-methoxyphenyl)-(4-pyrrolidin-1-yl-1-piperidyl)methanone; oxalic acid CAS Name: (4-methoxyphenyl)-[4-(1-pyrrolidinyl)-1-piperidinyl]methanone; oxalic acid IUPAC Name: (4-methoxyphenyl)-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone; oxalic acid Traditional Name: (4-methoxyphenyl)-(4-pyrrolidinopiperidino)methanone; oxalic acid Formula: C19H26N2O6 MolecularWeight: 378.41954

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N2CCC(CC2)N3CCCC3.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N2CCC(CC2)N3CCCC3.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H24N2O2.C2H2O4/c1-21-16-6-4-14(5-7-16)17(20)19-12-8-15(9-13-19)18-10-2-3-11-18;3-1(4)2(5)6/h4-7,15H,2-3,8-13H2,1H3;(H,3,4)(H,5,6)