6-bromanyl-1'-(1,5-dimethylpyrazol-3-yl)carbonyl-spiro[3H-chromene-2,4'-piperidine]-4-one

Systemtic Name: 6-bromanyl-1'-(1,5-dimethylpyrazol-3-yl)carbonyl-spiro[3H-chromene-2,4'-piperidine]-4-one Openeye Name: 6-bromo-1'-(1,5-dimethylpyrazole-3-carbonyl)spiro[chromane-2,4'-piperidine]-4-one CAS Name: 6-bromo-1'-[(1,5-dimethyl-3-pyrazolyl)-oxomethyl]-4-spiro[3,4-dihydro-2H-1-benzopyran-2,4'-piperidine]one IUPAC Name: 6-bromo-1'-(1,5-dimethylpyrazole-3-carbonyl)spiro[3H-chromene-2,4'-piperidine]-4-one Traditional Name: 6-bromo-1'-(1,5-dimethylpyrazole-3-carbonyl)spiro[chroman-2,4'-piperidine]-4-one Formula: C19H20BrN3O3 MolecularWeight: 418.2844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C)C(=O)N2CCC3(CC2)CC(=O)C4=C(O3)C=CC(=C4)Br

Isomeric SMILES

CC1=CC(=NN1C)C(=O)N2CCC3(CC2)CC(=O)C4=C(O3)C=CC(=C4)Br

InChI

InChI=1S/C19H20BrN3O3/c1-12-9-15(21-22(12)2)18(25)23-7-5-19(6-8-23)11-16(24)14-10-13(20)3-4-17(14)26-19/h3-4,9-10H,5-8,11H2,1-2H3