(E)-3-(4-chlorophenyl)-N-[6-(3-oxidanylpropylamino)pyridin-3-yl]prop-2-enamide

Systemtic Name: (E)-3-(4-chlorophenyl)-N-[6-(3-oxidanylpropylamino)pyridin-3-yl]prop-2-enamide Openeye Name: (E)-3-(4-chlorophenyl)-N-[6-(3-hydroxypropylamino)-3-pyridyl]prop-2-enamide CAS Name: (E)-3-(4-chlorophenyl)-N-[6-(3-hydroxypropylamino)-3-pyridinyl]-2-propenamide IUPAC Name: (E)-3-(4-chlorophenyl)-N-[6-(3-hydroxypropylamino)pyridin-3-yl]prop-2-enamide Traditional Name: (E)-3-(4-chlorophenyl)-N-[6-(3-hydroxypropylamino)-3-pyridyl]acrylamide Formula: C17H18ClN3O2 MolecularWeight: 331.79672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC(=O)NC2=CN=C(C=C2)NCCCO)Cl

Isomeric SMILES

C1=CC(=CC=C1/C=C/C(=O)NC2=CN=C(C=C2)NCCCO)Cl

InChI

InChI=1S/C17H18ClN3O2/c18-14-5-2-13(3-6-14)4-9-17(23)21-15-7-8-16(20-12-15)19-10-1-11-22/h2-9,12,22H,1,10-11H2,(H,19,20)(H,21,23)/b9-4+