3-methyl-2-[2-[(E)-3-oxidanylprop-1-enyl]phenyl]-2-(9H-xanthen-9-yl)butanamide

Systemtic Name: 3-methyl-2-[2-[(E)-3-oxidanylprop-1-enyl]phenyl]-2-(9H-xanthen-9-yl)butanamide Openeye Name: 2-[2-[(E)-3-hydroxyprop-1-enyl]phenyl]-3-methyl-2-(9H-xanthen-9-yl)butanamide CAS Name: 2-[2-[(E)-3-hydroxyprop-1-enyl]phenyl]-3-methyl-2-(9H-xanthen-9-yl)butanamide IUPAC Name: 2-[2-[(E)-3-hydroxyprop-1-enyl]phenyl]-3-methyl-2-(9H-xanthen-9-yl)butanamide Traditional Name: 2-[2-[(E)-3-hydroxyprop-1-enyl]phenyl]-3-methyl-2-(9H-xanthen-9-yl)butyramide Formula: C27H27NO3 MolecularWeight: 413.50818

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1C2=CC=CC=C2OC3=CC=CC=C13)(C4=CC=CC=C4C=CCO)C(=O)N

Isomeric SMILES

CC(C)C(C1C2=CC=CC=C2OC3=CC=CC=C13)(C4=CC=CC=C4/C=C/CO)C(=O)N

InChI

InChI=1S/C27H27NO3/c1-18(2)27(26(28)30,22-14-6-3-10-19(22)11-9-17-29)25-20-12-4-7-15-23(20)31-24-16-8-5-13-21(24)25/h3-16,18,25,29H,17H2,1-2H3,(H2,28,30)/b11-9+