[5-[(5-bromanyl-1H-pyrrol-2-yl)-phenyl-methyl]-1H-pyrrol-2-yl]-(5,5-dimethyl-1,3-dioxan-2-yl)methanone

Systemtic Name: [5-[(5-bromanyl-1H-pyrrol-2-yl)-phenyl-methyl]-1H-pyrrol-2-yl]-(5,5-dimethyl-1,3-dioxan-2-yl)methanone Openeye Name: [5-[(5-bromo-1H-pyrrol-2-yl)-phenyl-methyl]-1H-pyrrol-2-yl]-(5,5-dimethyl-1,3-dioxan-2-yl)methanone CAS Name: [5-[(5-bromo-1H-pyrrol-2-yl)-phenylmethyl]-1H-pyrrol-2-yl]-(5,5-dimethyl-1,3-dioxan-2-yl)methanone IUPAC Name: [5-[(5-bromo-1H-pyrrol-2-yl)-phenylmethyl]-1H-pyrrol-2-yl]-(5,5-dimethyl-1,3-dioxan-2-yl)methanone Traditional Name: [5-[(5-bromo-1H-pyrrol-2-yl)-phenyl-methyl]-1H-pyrrol-2-yl]-(5,5-dimethyl-1,3-dioxan-2-yl)methanone Formula: C22H23BrN2O3 MolecularWeight: 443.33362

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(OC1)C(=O)C2=CC=C(N2)C(C3=CC=CC=C3)C4=CC=C(N4)Br)C

Isomeric SMILES

CC1(COC(OC1)C(=O)C2=CC=C(N2)C(C3=CC=CC=C3)C4=CC=C(N4)Br)C

InChI

InChI=1S/C22H23BrN2O3/c1-22(2)12-27-21(28-13-22)20(26)17-9-8-15(24-17)19(14-6-4-3-5-7-14)16-10-11-18(23)25-16/h3-11,19,21,24-25H,12-13H2,1-2H3