8-chloranyl-2-methyl-spiro[2,5-dihydro-1,4-benzodioxepine-3,4'-piperidine]; ethanedioic acid

Systemtic Name: 8-chloranyl-2-methyl-spiro[2,5-dihydro-1,4-benzodioxepine-3,4'-piperidine]; ethanedioic acid Openeye Name: 8-chloro-2-methyl-spiro[2,5-dihydro-1,4-benzodioxepine-3,4'-piperidine]; oxalic acid CAS Name: 8-chloro-2-methylspiro[2,5-dihydro-1,4-benzodioxepin-3,4'-piperidine]; oxalic acid IUPAC Name: 8-chloro-2-methylspiro[2,5-dihydro-1,4-benzodioxepine-3,4'-piperidine]; oxalic acid Traditional Name: 8-chloro-2-methyl-spiro[2,5-dihydro-1,4-benzodioxepin-3,4'-piperidine]; oxalic acid Formula: C16H20ClNO6 MolecularWeight: 357.7861

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2(CCNCC2)OCC3=C(O1)C=C(C=C3)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

CC1C2(CCNCC2)OCC3=C(O1)C=C(C=C3)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H18ClNO2.C2H2O4/c1-10-14(4-6-16-7-5-14)17-9-11-2-3-12(15)8-13(11)18-10;3-1(4)2(5)6/h2-3,8,10,16H,4-7,9H2,1H3;(H,3,4)(H,5,6)