(E)-N-[4-azanyl-1-(2-chloroethyl)naphthalen-2-yl]-3-(6-methoxypyridin-3-yl)prop-2-enamide

Systemtic Name: (E)-N-[4-azanyl-1-(2-chloroethyl)naphthalen-2-yl]-3-(6-methoxypyridin-3-yl)prop-2-enamide Openeye Name: (E)-N-[4-amino-1-(2-chloroethyl)-2-naphthyl]-3-(6-methoxy-3-pyridyl)prop-2-enamide CAS Name: (E)-N-[4-amino-1-(2-chloroethyl)-2-naphthalenyl]-3-(6-methoxy-3-pyridinyl)-2-propenamide IUPAC Name: (E)-N-[4-amino-1-(2-chloroethyl)naphthalen-2-yl]-3-(6-methoxypyridin-3-yl)prop-2-enamide Traditional Name: (E)-N-[4-amino-1-(2-chloroethyl)-2-naphthyl]-3-(6-methoxy-3-pyridyl)acrylamide Formula: C21H20ClN3O2 MolecularWeight: 381.8554

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)C=CC(=O)NC2=C(C3=CC=CC=C3C(=C2)N)CCCl

Isomeric SMILES

COC1=NC=C(C=C1)/C=C/C(=O)NC2=C(C3=CC=CC=C3C(=C2)N)CCCl

InChI

InChI=1S/C21H20ClN3O2/c1-27-21-9-7-14(13-24-21)6-8-20(26)25-19-12-18(23)16-5-3-2-4-15(16)17(19)10-11-22/h2-9,12-13H,10-11,23H2,1H3,(H,25,26)/b8-6+