ethanedioic acid; N-pentan-3-yl-1-(phenylmethyl)piperidin-4-amine

Systemtic Name: ethanedioic acid; N-pentan-3-yl-1-(phenylmethyl)piperidin-4-amine Openeye Name: 1-benzyl-N-(1-ethylpropyl)piperidin-4-amine; oxalic acid CAS Name: oxalic acid; N-pentan-3-yl-1-(phenylmethyl)-4-piperidinamine IUPAC Name: 1-benzyl-N-pentan-3-ylpiperidin-4-amine; oxalic acid Traditional Name: (1-benzyl-4-piperidyl)-(1-ethylpropyl)amine; oxalic acid Formula: C19H30N2O4 MolecularWeight: 350.4525

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC1CCN(CC1)CC2=CC=CC=C2.C(=O)(C(=O)O)O

Isomeric SMILES

CCC(CC)NC1CCN(CC1)CC2=CC=CC=C2.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H28N2.C2H2O4/c1-3-16(4-2)18-17-10-12-19(13-11-17)14-15-8-6-5-7-9-15;3-1(4)2(5)6/h5-9,16-18H,3-4,10-14H2,1-2H3;(H,3,4)(H,5,6)