1-[3-(4-bromophenyl)-3a,4,5a,6,7,8,9,9a-octahydro-3H-chromeno[4,3-c]pyrazol-2-yl]ethanone

Systemtic Name: 1-[3-(4-bromophenyl)-3a,4,5a,6,7,8,9,9a-octahydro-3H-chromeno[4,3-c]pyrazol-2-yl]ethanone Openeye Name: 1-[3-(4-bromophenyl)-3a,4,5a,6,7,8,9,9a-octahydro-3H-chromeno[4,3-c]pyrazol-2-yl]ethanone CAS Name: 1-[3-(4-bromophenyl)-3a,4,5a,6,7,8,9,9a-octahydro-3H-[1]benzopyrano[4,3-c]pyrazol-2-yl]ethanone IUPAC Name: 1-[3-(4-bromophenyl)-3a,4,5a,6,7,8,9,9a-octahydro-3H-chromeno[4,3-c]pyrazol-2-yl]ethanone Traditional Name: 1-[3-(4-bromophenyl)-3a,4,5a,6,7,8,9,9a-octahydro-3H-chromeno[4,3-c]pyrazol-2-yl]ethanone Formula: C18H21BrN2O2 MolecularWeight: 377.27554

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(C2COC3CCCCC3C2=N1)C4=CC=C(C=C4)Br

Isomeric SMILES

CC(=O)N1C(C2COC3CCCCC3C2=N1)C4=CC=C(C=C4)Br

InChI

InChI=1S/C18H21BrN2O2/c1-11(22)21-18(12-6-8-13(19)9-7-12)15-10-23-16-5-3-2-4-14(16)17(15)20-21/h6-9,14-16,18H,2-5,10H2,1H3