4-[6-chloranyl-1-(3-oxidanylidenebutyl)-2-phenyl-indol-3-yl]butan-2-one

Systemtic Name: 4-[6-chloranyl-1-(3-oxidanylidenebutyl)-2-phenyl-indol-3-yl]butan-2-one Openeye Name: 4-[6-chloro-1-(3-oxobutyl)-2-phenyl-indol-3-yl]butan-2-one CAS Name: 4-[6-chloro-1-(3-oxobutyl)-2-phenyl-3-indolyl]-2-butanone IUPAC Name: 4-[6-chloro-1-(3-oxobutyl)-2-phenylindol-3-yl]butan-2-one Traditional Name: 4-[6-chloro-1-(3-ketobutyl)-2-phenyl-indol-3-yl]butan-2-one Formula: C22H22ClNO2 MolecularWeight: 367.86858

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1=C(N(C2=C1C=CC(=C2)Cl)CCC(=O)C)C3=CC=CC=C3

Isomeric SMILES

CC(=O)CCC1=C(N(C2=C1C=CC(=C2)Cl)CCC(=O)C)C3=CC=CC=C3

InChI

InChI=1S/C22H22ClNO2/c1-15(25)8-10-20-19-11-9-18(23)14-21(19)24(13-12-16(2)26)22(20)17-6-4-3-5-7-17/h3-7,9,11,14H,8,10,12-13H2,1-2H3