methyl 4-[2-[[1-(6-chloranylpyridin-2-yl)-2-oxidanyl-ethyl]amino]propyl]benzoate

Systemtic Name: methyl 4-[2-[[1-(6-chloranylpyridin-2-yl)-2-oxidanyl-ethyl]amino]propyl]benzoate Openeye Name: methyl 4-[2-[[1-(6-chloro-2-pyridyl)-2-hydroxy-ethyl]amino]propyl]benzoate CAS Name: 4-[2-[[1-(6-chloro-2-pyridinyl)-2-hydroxyethyl]amino]propyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[[1-(6-chloropyridin-2-yl)-2-hydroxyethyl]amino]propyl]benzoate Traditional Name: 4-[2-[[1-(6-chloro-2-pyridyl)-2-hydroxy-ethyl]amino]propyl]benzoic acid methyl ester Formula: C18H21ClN2O3 MolecularWeight: 348.82394

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)C(=O)OC)NC(CO)C2=NC(=CC=C2)Cl

Isomeric SMILES

CC(CC1=CC=C(C=C1)C(=O)OC)NC(CO)C2=NC(=CC=C2)Cl

InChI

InChI=1S/C18H21ClN2O3/c1-12(10-13-6-8-14(9-7-13)18(23)24-2)20-16(11-22)15-4-3-5-17(19)21-15/h3-9,12,16,20,22H,10-11H2,1-2H3