ethanedioic acid; 1-methyl-5,6,7,8-tetrahydro-4H-pyrrolo[2,3-d]azepine

Systemtic Name: ethanedioic acid; 1-methyl-5,6,7,8-tetrahydro-4H-pyrrolo[2,3-d]azepine Openeye Name: 1-methyl-5,6,7,8-tetrahydro-4H-pyrrolo[2,3-d]azepine; oxalic acid CAS Name: 1-methyl-5,6,7,8-tetrahydro-4H-pyrrolo[2,3-d]azepine; oxalic acid IUPAC Name: 1-methyl-5,6,7,8-tetrahydro-4H-pyrrolo[2,3-d]azepine; oxalic acid Traditional Name: 1-methyl-5,6,7,8-tetrahydro-4H-pyrrol[2,3-d]azepine; oxalic acid Formula: C11H16N2O4 MolecularWeight: 240.25574

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C1CCNCC2.C(=O)(C(=O)O)O

Isomeric SMILES

CN1C=CC2=C1CCNCC2.C(=O)(C(=O)O)O

InChI

InChI=1S/C9H14N2.C2H2O4/c1-11-7-4-8-2-5-10-6-3-9(8)11;3-1(4)2(5)6/h4,7,10H,2-3,5-6H2,1H3;(H,3,4)(H,5,6)