4-[1-(3-oxidanylidenebutyl)-2-phenyl-indol-3-yl]octan-2-one

Systemtic Name: 4-[1-(3-oxidanylidenebutyl)-2-phenyl-indol-3-yl]octan-2-one Openeye Name: 4-[1-(3-oxobutyl)-2-phenyl-indol-3-yl]octan-2-one CAS Name: 4-[1-(3-oxobutyl)-2-phenyl-3-indolyl]-2-octanone IUPAC Name: 4-[1-(3-oxobutyl)-2-phenylindol-3-yl]octan-2-one Traditional Name: 4-[1-(3-ketobutyl)-2-phenyl-indol-3-yl]octan-2-one Formula: C26H31NO2 MolecularWeight: 389.52984

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(=O)C)C1=C(N(C2=CC=CC=C21)CCC(=O)C)C3=CC=CC=C3

Isomeric SMILES

CCCCC(CC(=O)C)C1=C(N(C2=CC=CC=C21)CCC(=O)C)C3=CC=CC=C3

InChI

InChI=1S/C26H31NO2/c1-4-5-11-22(18-20(3)29)25-23-14-9-10-15-24(23)27(17-16-19(2)28)26(25)21-12-7-6-8-13-21/h6-10,12-15,22H,4-5,11,16-18H2,1-3H3