(3,5-dimethoxyphenyl)-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone; ethanedioic acid

Systemtic Name: (3,5-dimethoxyphenyl)-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone; ethanedioic acid Openeye Name: (3,5-dimethoxyphenyl)-(4-pyrrolidin-1-yl-1-piperidyl)methanone; oxalic acid CAS Name: (3,5-dimethoxyphenyl)-[4-(1-pyrrolidinyl)-1-piperidinyl]methanone; oxalic acid IUPAC Name: (3,5-dimethoxyphenyl)-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone; oxalic acid Traditional Name: (3,5-dimethoxyphenyl)-(4-pyrrolidinopiperidino)methanone; oxalic acid Formula: C20H28N2O7 MolecularWeight: 408.44552

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N2O3.C2H2O4/c1-22-16-11-14(12-17(13-16)23-2)18(21)20-9-5-15(6-10-20)19-7-3-4-8-19;3-1(4)2(5)6/h11-13,15H,3-10H2,1-2H3;(H,3,4)(H,5,6)