(2S)-3-(4-chloranyl-2,6-dimethyl-phenoxy)-2-methyl-propan-1-amine

Systemtic Name: (2S)-3-(4-chloranyl-2,6-dimethyl-phenoxy)-2-methyl-propan-1-amine Openeye Name: (2S)-3-(4-chloro-2,6-dimethyl-phenoxy)-2-methyl-propan-1-amine CAS Name: (2S)-3-(4-chloro-2,6-dimethylphenoxy)-2-methyl-1-propanamine IUPAC Name: (2S)-3-(4-chloro-2,6-dimethylphenoxy)-2-methylpropan-1-amine Traditional Name: [(2S)-3-(4-chloro-2,6-dimethyl-phenoxy)-2-methyl-propyl]amine Formula: C12H18ClNO MolecularWeight: 227.73042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(C)CN)C)Cl

Isomeric SMILES

CC1=CC(=CC(=C1OC[C@@H](C)CN)C)Cl

InChI

InChI=1S/C12H18ClNO/c1-8(6-14)7-15-12-9(2)4-11(13)5-10(12)3/h4-5,8H,6-7,14H2,1-3H3/t8-/m0/s1