4-bromanyl-2-[(4-piperidin-1-ylpiperidin-1-yl)methyl]phenol; ethanedioic acid

Systemtic Name: 4-bromanyl-2-[(4-piperidin-1-ylpiperidin-1-yl)methyl]phenol; ethanedioic acid Openeye Name: 4-bromo-2-[[4-(1-piperidyl)-1-piperidyl]methyl]phenol; oxalic acid CAS Name: 4-bromo-2-[[4-(1-piperidinyl)-1-piperidinyl]methyl]phenol; oxalic acid IUPAC Name: 4-bromo-2-[(4-piperidin-1-ylpiperidin-1-yl)methyl]phenol; oxalic acid Traditional Name: 4-bromo-2-[(4-piperidinopiperidino)methyl]phenol; oxalic acid Formula: C19H27BrN2O5 MolecularWeight: 443.33208

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2CCN(CC2)CC3=C(C=CC(=C3)Br)O.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCN(CC1)C2CCN(CC2)CC3=C(C=CC(=C3)Br)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H25BrN2O.C2H2O4/c18-15-4-5-17(21)14(12-15)13-19-10-6-16(7-11-19)20-8-2-1-3-9-20;3-1(4)2(5)6/h4-5,12,16,21H,1-3,6-11,13H2;(H,3,4)(H,5,6)