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

Systemtic Name: (E)-N-[4-(7-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-3-phenyl-prop-2-enamide Openeye Name: (E)-N-[4-(7-hydroxy-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-[4-(7-hydroxy-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-3-phenyl-2-propenamide IUPAC Name: (E)-N-[4-(7-hydroxy-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-3-phenylprop-2-enamide Traditional Name: (E)-N-[4-(7-hydroxy-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-3-phenyl-acrylamide Formula: C22H26N2O2 MolecularWeight: 350.45404

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)O)CCCCNC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)O)CCCCNC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C22H26N2O2/c25-21-10-9-19-12-15-24(17-20(19)16-21)14-5-4-13-23-22(26)11-8-18-6-2-1-3-7-18/h1-3,6-11,16,25H,4-5,12-15,17H2,(H,23,26)/b11-8+