2-[[(3R)-5-bromanyl-1-ethyl-2-oxidanylidene-3H-indol-3-yl]methyl]-3-(3-oxidanylpropyl)quinazolin-4-one

Systemtic Name: 2-[[(3R)-5-bromanyl-1-ethyl-2-oxidanylidene-3H-indol-3-yl]methyl]-3-(3-oxidanylpropyl)quinazolin-4-one Openeye Name: 2-[[(3R)-5-bromo-1-ethyl-2-oxo-indolin-3-yl]methyl]-3-(3-hydroxypropyl)quinazolin-4-one CAS Name: 2-[[(3R)-5-bromo-1-ethyl-2-oxo-3H-indol-3-yl]methyl]-3-(3-hydroxypropyl)-4-quinazolinone IUPAC Name: 2-[[(3R)-5-bromo-1-ethyl-2-oxo-3H-indol-3-yl]methyl]-3-(3-hydroxypropyl)quinazolin-4-one Traditional Name: 2-[[(3R)-5-bromo-1-ethyl-2-keto-indolin-3-yl]methyl]-3-(3-hydroxypropyl)quinazolin-4-one Formula: C22H22BrN3O3 MolecularWeight: 456.33238

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)Br)C(C1=O)CC3=NC4=CC=CC=C4C(=O)N3CCCO

Isomeric SMILES

CCN1C2=C(C=C(C=C2)Br)[C@H](C1=O)CC3=NC4=CC=CC=C4C(=O)N3CCCO

InChI

InChI=1S/C22H22BrN3O3/c1-2-25-19-9-8-14(23)12-16(19)17(22(25)29)13-20-24-18-7-4-3-6-15(18)21(28)26(20)10-5-11-27/h3-4,6-9,12,17,27H,2,5,10-11,13H2,1H3/t17-/m1/s1