2-diethylaminoethyl 4-azanyl-3-iodanyl-benzoate hydrochloride

Systemtic Name: 2-diethylaminoethyl 4-azanyl-3-iodanyl-benzoate hydrochloride Openeye Name: 2-diethylaminoethyl 4-amino-3-iodo-benzoate hydrochloride CAS Name: 4-amino-3-iodobenzoic acid 2-diethylaminoethyl ester hydrochloride IUPAC Name: 2-diethylaminoethyl 4-amino-3-iodobenzoate hydrochloride Traditional Name: 4-amino-3-iodo-benzoic acid 2-diethylaminoethyl ester hydrochloride Formula: C13H20ClIN2O2 MolecularWeight: 398.66757

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CC(=C(C=C1)N)I.Cl

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CC(=C(C=C1)N)I.Cl

InChI

InChI=1S/C13H19IN2O2.ClH/c1-3-16(4-2)7-8-18-13(17)10-5-6-12(15)11(14)9-10;/h5-6,9H,3-4,7-8,15H2,1-2H3;1H