(E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)-N-(6-pyrrolidin-1-ylpyridin-3-yl)prop-2-enamide

Systemtic Name: (E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)-N-(6-pyrrolidin-1-ylpyridin-3-yl)prop-2-enamide Openeye Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-N-(6-pyrrolidin-1-yl-3-pyridyl)prop-2-enamide CAS Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-N-[6-(1-pyrrolidinyl)-3-pyridinyl]-2-propenamide IUPAC Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-N-(6-pyrrolidin-1-ylpyridin-3-yl)prop-2-enamide Traditional Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-N-(6-pyrrolidino-3-pyridyl)acrylamide Formula: C19H18ClN3O3 MolecularWeight: 371.81752

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC=C(C=C2)NC(=O)C=CC3=CC4=C(C(=C3)Cl)OCO4

Isomeric SMILES

C1CCN(C1)C2=NC=C(C=C2)NC(=O)/C=C/C3=CC4=C(C(=C3)Cl)OCO4

InChI

InChI=1S/C19H18ClN3O3/c20-15-9-13(10-16-19(15)26-12-25-16)3-6-18(24)22-14-4-5-17(21-11-14)23-7-1-2-8-23/h3-6,9-11H,1-2,7-8,12H2,(H,22,24)/b6-3+