(E)-N-[4-(7-cyano-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-3-naphthalen-2-yl-prop-2-enamide

Systemtic Name: (E)-N-[4-(7-cyano-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-3-naphthalen-2-yl-prop-2-enamide Openeye Name: (E)-N-[4-(7-cyano-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-3-(2-naphthyl)prop-2-enamide CAS Name: (E)-N-[4-(7-cyano-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-3-(2-naphthalenyl)-2-propenamide IUPAC Name: (E)-N-[4-(7-cyano-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-3-naphthalen-2-ylprop-2-enamide Traditional Name: (E)-N-[4-(7-cyano-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-3-(2-naphthyl)acrylamide Formula: C27H27N3O MolecularWeight: 409.52278

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)C#N)CCCCNC(=O)C=CC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)C#N)CCCCNC(=O)/C=C/C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C27H27N3O/c28-19-22-8-11-24-13-16-30(20-26(24)18-22)15-4-3-14-29-27(31)12-9-21-7-10-23-5-1-2-6-25(23)17-21/h1-2,5-12,17-18H,3-4,13-16,20H2,(H,29,31)/b12-9+