(E)-3-(3-chloranyl-5-methoxy-4-propan-2-yloxy-phenyl)-2-cyano-N-(phenylmethyl)prop-2-enamide

Systemtic Name: (E)-3-(3-chloranyl-5-methoxy-4-propan-2-yloxy-phenyl)-2-cyano-N-(phenylmethyl)prop-2-enamide Openeye Name: (E)-N-benzyl-3-(3-chloro-4-isopropoxy-5-methoxy-phenyl)-2-cyano-prop-2-enamide CAS Name: (E)-3-(3-chloro-5-methoxy-4-propan-2-yloxyphenyl)-2-cyano-N-(phenylmethyl)-2-propenamide IUPAC Name: (E)-N-benzyl-3-(3-chloro-5-methoxy-4-propan-2-yloxyphenyl)-2-cyanoprop-2-enamide Traditional Name: (E)-N-benzyl-3-(3-chloro-4-isopropoxy-5-methoxy-phenyl)-2-cyano-acrylamide Formula: C21H21ClN2O3 MolecularWeight: 384.85604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1Cl)C=C(C#N)C(=O)NCC2=CC=CC=C2)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1Cl)/C=C(\C#N)/C(=O)NCC2=CC=CC=C2)OC

InChI

InChI=1S/C21H21ClN2O3/c1-14(2)27-20-18(22)10-16(11-19(20)26-3)9-17(12-23)21(25)24-13-15-7-5-4-6-8-15/h4-11,14H,13H2,1-3H3,(H,24,25)/b17-9+