propan-2-yl 3-[3-azanyl-2,4,6-tris(chloranyl)phenyl]pentanoate

Systemtic Name: propan-2-yl 3-[3-azanyl-2,4,6-tris(chloranyl)phenyl]pentanoate Openeye Name: isopropyl 3-(3-amino-2,4,6-trichloro-phenyl)pentanoate CAS Name: 3-(3-amino-2,4,6-trichlorophenyl)pentanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-(3-amino-2,4,6-trichlorophenyl)pentanoate Traditional Name: 3-(3-amino-2,4,6-trichloro-phenyl)valeric acid isopropyl ester Formula: C14H18Cl3NO2 MolecularWeight: 338.65722

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=O)OC(C)C)C1=C(C(=C(C=C1Cl)Cl)N)Cl

Isomeric SMILES

CCC(CC(=O)OC(C)C)C1=C(C(=C(C=C1Cl)Cl)N)Cl

InChI

InChI=1S/C14H18Cl3NO2/c1-4-8(5-11(19)20-7(2)3)12-9(15)6-10(16)14(18)13(12)17/h6-8H,4-5,18H2,1-3H3