ethanedioic acid; 2-(4-methyl-1,4-diazepan-1-yl)-1-phenyl-ethanol

Systemtic Name: ethanedioic acid; 2-(4-methyl-1,4-diazepan-1-yl)-1-phenyl-ethanol Openeye Name: 2-(4-methyl-1,4-diazepan-1-yl)-1-phenyl-ethanol; oxalic acid CAS Name: 2-(4-methyl-1,4-diazepan-1-yl)-1-phenylethanol; oxalic acid IUPAC Name: 2-(4-methyl-1,4-diazepan-1-yl)-1-phenylethanol; oxalic acid Traditional Name: 2-(4-methyl-1,4-diazepan-1-yl)-1-phenyl-ethanol; oxalic acid Formula: C16H24N2O5 MolecularWeight: 324.37216

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)CC(C2=CC=CC=C2)O.C(=O)(C(=O)O)O

Isomeric SMILES

CN1CCCN(CC1)CC(C2=CC=CC=C2)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H22N2O.C2H2O4/c1-15-8-5-9-16(11-10-15)12-14(17)13-6-3-2-4-7-13;3-1(4)2(5)6/h2-4,6-7,14,17H,5,8-12H2,1H3;(H,3,4)(H,5,6)