(E)-3-(4-chloranyl-3-methoxy-phenyl)prop-2-en-1-amine hydrochloride

Systemtic Name: (E)-3-(4-chloranyl-3-methoxy-phenyl)prop-2-en-1-amine hydrochloride Openeye Name: (E)-3-(4-chloro-3-methoxy-phenyl)prop-2-en-1-amine hydrochloride CAS Name: (E)-3-(4-chloro-3-methoxyphenyl)-2-propen-1-amine hydrochloride IUPAC Name: (E)-3-(4-chloro-3-methoxyphenyl)prop-2-en-1-amine hydrochloride Traditional Name: [(E)-3-(4-chloro-3-methoxy-phenyl)allyl]amine hydrochloride Formula: C10H13Cl2NO MolecularWeight: 234.12232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CCN)Cl.Cl

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/CN)Cl.Cl

InChI

InChI=1S/C10H12ClNO.ClH/c1-13-10-7-8(3-2-6-12)4-5-9(10)11;/h2-5,7H,6,12H2,1H3;1H/b3-2+;