(2S)-1-[6-chloranyl-5-[(E)-2-pyridin-4-ylethenyl]pyridin-3-yl]oxy-N,N-dimethyl-butan-2-amine

Systemtic Name: (2S)-1-[6-chloranyl-5-[(E)-2-pyridin-4-ylethenyl]pyridin-3-yl]oxy-N,N-dimethyl-butan-2-amine Openeye Name: (2S)-1-[[6-chloro-5-[(E)-2-(4-pyridyl)vinyl]-3-pyridyl]oxy]-N,N-dimethyl-butan-2-amine CAS Name: (2S)-1-[[6-chloro-5-[(E)-2-pyridin-4-ylethenyl]-3-pyridinyl]oxy]-N,N-dimethyl-2-butanamine IUPAC Name: (2S)-1-[6-chloro-5-[(E)-2-pyridin-4-ylethenyl]pyridin-3-yl]oxy-N,N-dimethylbutan-2-amine Traditional Name: [(1S)-1-[[6-chloro-5-[(E)-2-(4-pyridyl)vinyl]-3-pyridyl]oxymethyl]propyl]-dimethyl-amine Formula: C18H22ClN3O MolecularWeight: 331.83978

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COC1=CN=C(C(=C1)C=CC2=CC=NC=C2)Cl)N(C)C

Isomeric SMILES

CC[C@@H](COC1=CN=C(C(=C1)/C=C/C2=CC=NC=C2)Cl)N(C)C

InChI

InChI=1S/C18H22ClN3O/c1-4-16(22(2)3)13-23-17-11-15(18(19)21-12-17)6-5-14-7-9-20-10-8-14/h5-12,16H,4,13H2,1-3H3/b6-5+/t16-/m0/s1