N-[1-(4-butan-2-ylphenyl)propyl]-9H-xanthene-9-carboxamide

Systemtic Name: N-[1-(4-butan-2-ylphenyl)propyl]-9H-xanthene-9-carboxamide Openeye Name: N-[1-(4-sec-butylphenyl)propyl]-9H-xanthene-9-carboxamide CAS Name: N-[1-(4-butan-2-ylphenyl)propyl]-9H-xanthene-9-carboxamide IUPAC Name: N-[1-(4-butan-2-ylphenyl)propyl]-9H-xanthene-9-carboxamide Traditional Name: N-[1-(4-sec-butylphenyl)propyl]-9H-xanthene-9-carboxamide Formula: C27H29NO2 MolecularWeight: 399.52466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C(CC)NC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C(CC)NC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24

InChI

InChI=1S/C27H29NO2/c1-4-18(3)19-14-16-20(17-15-19)23(5-2)28-27(29)26-21-10-6-8-12-24(21)30-25-13-9-7-11-22(25)26/h6-18,23,26H,4-5H2,1-3H3,(H,28,29)