6,8-bis(bromanyl)-3-[4-(phenylmethyl)piperidin-1-yl]carbonyl-chromen-2-one

Systemtic Name: 6,8-bis(bromanyl)-3-[4-(phenylmethyl)piperidin-1-yl]carbonyl-chromen-2-one Openeye Name: 3-(4-benzylpiperidine-1-carbonyl)-6,8-dibromo-chromen-2-one CAS Name: 6,8-dibromo-3-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]-1-benzopyran-2-one IUPAC Name: 3-(4-benzylpiperidine-1-carbonyl)-6,8-dibromochromen-2-one Traditional Name: 3-(4-benzylpiperidine-1-carbonyl)-6,8-dibromo-coumarin Formula: C22H19Br2NO3 MolecularWeight: 505.19916

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)C3=CC4=CC(=CC(=C4OC3=O)Br)Br

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)C3=CC4=CC(=CC(=C4OC3=O)Br)Br

InChI

InChI=1S/C22H19Br2NO3/c23-17-11-16-12-18(22(27)28-20(16)19(24)13-17)21(26)25-8-6-15(7-9-25)10-14-4-2-1-3-5-14/h1-5,11-13,15H,6-10H2