[3,5-bis(azanyl)-4-chloranyl-phenyl] hexanoate

Systemtic Name: [3,5-bis(azanyl)-4-chloranyl-phenyl] hexanoate Openeye Name: (3,5-diamino-4-chloro-phenyl) hexanoate CAS Name: hexanoic acid (3,5-diamino-4-chlorophenyl) ester IUPAC Name: (3,5-diamino-4-chlorophenyl) hexanoate Traditional Name: hexanoic acid (3,5-diamino-4-chloro-phenyl) ester Formula: C12H17ClN2O2 MolecularWeight: 256.72858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC1=CC(=C(C(=C1)N)Cl)N

Isomeric SMILES

CCCCCC(=O)OC1=CC(=C(C(=C1)N)Cl)N

InChI

InChI=1S/C12H17ClN2O2/c1-2-3-4-5-11(16)17-8-6-9(14)12(13)10(15)7-8/h6-7H,2-5,14-15H2,1H3