N-[2-(3-oxidanylpropoxymethyl)-6-propan-2-yl-phenyl]-2-(9H-xanthen-9-yl)ethanamide

Systemtic Name: N-[2-(3-oxidanylpropoxymethyl)-6-propan-2-yl-phenyl]-2-(9H-xanthen-9-yl)ethanamide Openeye Name: N-[2-(3-hydroxypropoxymethyl)-6-isopropyl-phenyl]-2-(9H-xanthen-9-yl)acetamide CAS Name: N-[2-(3-hydroxypropoxymethyl)-6-propan-2-ylphenyl]-2-(9H-xanthen-9-yl)acetamide IUPAC Name: N-[2-(3-hydroxypropoxymethyl)-6-propan-2-ylphenyl]-2-(9H-xanthen-9-yl)acetamide Traditional Name: N-[2-(3-hydroxypropoxymethyl)-6-isopropyl-phenyl]-2-(9H-xanthen-9-yl)acetamide Formula: C28H31NO4 MolecularWeight: 445.55004

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC(=C1NC(=O)CC2C3=CC=CC=C3OC4=CC=CC=C24)COCCCO

Isomeric SMILES

CC(C)C1=CC=CC(=C1NC(=O)CC2C3=CC=CC=C3OC4=CC=CC=C24)COCCCO

InChI

InChI=1S/C28H31NO4/c1-19(2)21-12-7-9-20(18-32-16-8-15-30)28(21)29-27(31)17-24-22-10-3-5-13-25(22)33-26-14-6-4-11-23(24)26/h3-7,9-14,19,24,30H,8,15-18H2,1-2H3,(H,29,31)