ethanedioic acid; 1-[1-(naphthalen-1-ylmethyl)piperidin-4-yl]azepane

Systemtic Name: ethanedioic acid; 1-[1-(naphthalen-1-ylmethyl)piperidin-4-yl]azepane Openeye Name: 1-[1-(1-naphthylmethyl)-4-piperidyl]azepane; oxalic acid CAS Name: 1-[1-(1-naphthalenylmethyl)-4-piperidinyl]azepane; oxalic acid IUPAC Name: 1-[1-(naphthalen-1-ylmethyl)piperidin-4-yl]azepane; oxalic acid Traditional Name: 1-[1-(1-naphthylmethyl)-4-piperidyl]azepane; oxalic acid Formula: C24H32N2O4 MolecularWeight: 412.52188

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2CCN(CC2)CC3=CC=CC4=CC=CC=C43.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCCN(CC1)C2CCN(CC2)CC3=CC=CC4=CC=CC=C43.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H30N2.C2H2O4/c1-2-6-15-24(14-5-1)21-12-16-23(17-13-21)18-20-10-7-9-19-8-3-4-11-22(19)20;3-1(4)2(5)6/h3-4,7-11,21H,1-2,5-6,12-18H2;(H,3,4)(H,5,6)