[1-(phenylmethyl)piperidin-4-yl] 2-azanyl-4-iodanyl-benzoate hydrochloride

Systemtic Name: [1-(phenylmethyl)piperidin-4-yl] 2-azanyl-4-iodanyl-benzoate hydrochloride Openeye Name: (1-benzyl-4-piperidyl) 2-amino-4-iodo-benzoate hydrochloride CAS Name: 2-amino-4-iodobenzoic acid [1-(phenylmethyl)-4-piperidinyl] ester hydrochloride IUPAC Name: (1-benzylpiperidin-4-yl) 2-amino-4-iodobenzoate hydrochloride Traditional Name: 2-amino-4-iodo-benzoic acid (1-benzyl-4-piperidyl) ester hydrochloride Formula: C19H22ClIN2O2 MolecularWeight: 472.74765

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC(=O)C2=C(C=C(C=C2)I)N)CC3=CC=CC=C3.Cl

Isomeric SMILES

C1CN(CCC1OC(=O)C2=C(C=C(C=C2)I)N)CC3=CC=CC=C3.Cl

InChI

InChI=1S/C19H21IN2O2.ClH/c20-15-6-7-17(18(21)12-15)19(23)24-16-8-10-22(11-9-16)13-14-4-2-1-3-5-14;/h1-7,12,16H,8-11,13,21H2;1H