5-(2-chloranyl-4-methyl-phenoxy)pentane-1,3-diamine

Systemtic Name: 5-(2-chloranyl-4-methyl-phenoxy)pentane-1,3-diamine Openeye Name: 5-(2-chloro-4-methyl-phenoxy)pentane-1,3-diamine CAS Name: 5-(2-chloro-4-methylphenoxy)pentane-1,3-diamine IUPAC Name: 5-(2-chloro-4-methylphenoxy)pentane-1,3-diamine Traditional Name: [3-amino-5-(2-chloro-4-methyl-phenoxy)pentyl]amine Formula: C12H19ClN2O MolecularWeight: 242.74506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCC(CCN)N)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)OCCC(CCN)N)Cl

InChI

InChI=1S/C12H19ClN2O/c1-9-2-3-12(11(13)8-9)16-7-5-10(15)4-6-14/h2-3,8,10H,4-7,14-15H2,1H3