N-[(5-chloranyl-2-prop-2-enoxy-phenyl)methyl]-1-pyridin-3-yl-methanamine hydrochloride

Systemtic Name: N-[(5-chloranyl-2-prop-2-enoxy-phenyl)methyl]-1-pyridin-3-yl-methanamine hydrochloride Openeye Name: N-[(2-allyloxy-5-chloro-phenyl)methyl]-1-(3-pyridyl)methanamine hydrochloride CAS Name: N-[(5-chloro-2-prop-2-enoxyphenyl)methyl]-1-(3-pyridinyl)methanamine hydrochloride IUPAC Name: N-[(5-chloro-2-prop-2-enoxyphenyl)methyl]-1-pyridin-3-ylmethanamine hydrochloride Traditional Name: (2-allyloxy-5-chloro-benzyl)-(3-pyridylmethyl)amine hydrochloride Formula: C16H18Cl2N2O MolecularWeight: 325.23292

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=C(C=C(C=C1)Cl)CNCC2=CN=CC=C2.Cl

Isomeric SMILES

C=CCOC1=C(C=C(C=C1)Cl)CNCC2=CN=CC=C2.Cl

InChI

InChI=1S/C16H17ClN2O.ClH/c1-2-8-20-16-6-5-15(17)9-14(16)12-19-11-13-4-3-7-18-10-13;/h2-7,9-10,19H,1,8,11-12H2;1H