4-azanyl-1-(phenylmethyl)piperidine-4-carboxylate; ethanedioate; $l^{3}-carbane

Systemtic Name: 4-azanyl-1-(phenylmethyl)piperidine-4-carboxylate; ethanedioate; $l^{3}-carbane Openeye Name: 4-amino-1-benzyl-piperidine-4-carboxylate; $l^{3}-carbane; oxalate CAS Name: 4-amino-1-(phenylmethyl)-4-piperidinecarboxylate; $l^{3}-carbane; oxalate IUPAC Name: 4-amino-1-benzylpiperidine-4-carboxylate; $l^{3}-carbane; oxalate Traditional Name: 4-amino-1-benzyl-isonipecotate; $l^{3}-carbane; oxalate Formula: C16H20N2O6-3 MolecularWeight: 336.3398

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Descriptors Computed from Structure

Canonical SMILES:

[CH3].C1CN(CCC1(C(=O)[O-])N)CC2=CC=CC=C2.C(=O)(C(=O)[O-])[O-]

Isomeric SMILES

[CH3].C1CN(CCC1(C(=O)[O-])N)CC2=CC=CC=C2.C(=O)(C(=O)[O-])[O-]

InChI

InChI=1S/C13H18N2O2.C2H2O4.CH3/c14-13(12(16)17)6-8-15(9-7-13)10-11-4-2-1-3-5-11;3-1(4)2(5)6;/h1-5H,6-10,14H2,(H,16,17);(H,3,4)(H,5,6);1H3/p-3