(E)-N-cycloheptyl-3-(6-methoxy-7-methyl-3-phenyl-1-benzofuran-5-yl)but-2-enamide

Systemtic Name: (E)-N-cycloheptyl-3-(6-methoxy-7-methyl-3-phenyl-1-benzofuran-5-yl)but-2-enamide Openeye Name: (E)-N-cycloheptyl-3-(6-methoxy-7-methyl-3-phenyl-benzofuran-5-yl)but-2-enamide CAS Name: (E)-N-cycloheptyl-3-(6-methoxy-7-methyl-3-phenyl-5-benzofuranyl)-2-butenamide IUPAC Name: (E)-N-cycloheptyl-3-(6-methoxy-7-methyl-3-phenyl-1-benzofuran-5-yl)but-2-enamide Traditional Name: (E)-N-cycloheptyl-3-(6-methoxy-7-methyl-3-phenyl-benzofuran-5-yl)but-2-enamide Formula: C27H31NO3 MolecularWeight: 417.53994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1OC)C(=CC(=O)NC3CCCCCC3)C)C(=CO2)C4=CC=CC=C4

Isomeric SMILES

CC1=C2C(=CC(=C1OC)/C(=C/C(=O)NC3CCCCCC3)/C)C(=CO2)C4=CC=CC=C4

InChI

InChI=1S/C27H31NO3/c1-18(15-25(29)28-21-13-9-4-5-10-14-21)22-16-23-24(20-11-7-6-8-12-20)17-31-27(23)19(2)26(22)30-3/h6-8,11-12,15-17,21H,4-5,9-10,13-14H2,1-3H3,(H,28,29)/b18-15+