4-(2-bromanyl-4-ethyl-phenoxy)-1-(3,4-dihydro-2H-quinolin-1-yl)butan-1-one

Systemtic Name: 4-(2-bromanyl-4-ethyl-phenoxy)-1-(3,4-dihydro-2H-quinolin-1-yl)butan-1-one Openeye Name: 4-(2-bromo-4-ethyl-phenoxy)-1-(3,4-dihydro-2H-quinolin-1-yl)butan-1-one CAS Name: 4-(2-bromo-4-ethylphenoxy)-1-(3,4-dihydro-2H-quinolin-1-yl)-1-butanone IUPAC Name: 4-(2-bromo-4-ethylphenoxy)-1-(3,4-dihydro-2H-quinolin-1-yl)butan-1-one Traditional Name: 4-(2-bromo-4-ethyl-phenoxy)-1-(3,4-dihydro-2H-quinolin-1-yl)butan-1-one Formula: C21H24BrNO2 MolecularWeight: 402.32476

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCCCC(=O)N2CCCC3=CC=CC=C32)Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCCCC(=O)N2CCCC3=CC=CC=C32)Br

InChI

InChI=1S/C21H24BrNO2/c1-2-16-11-12-20(18(22)15-16)25-14-6-10-21(24)23-13-5-8-17-7-3-4-9-19(17)23/h3-4,7,9,11-12,15H,2,5-6,8,10,13-14H2,1H3