1-[5-[3,5-bis(bromanyl)-2-methoxy-phenyl]-1-ethyl-pyrrol-2-yl]azepane

Systemtic Name: 1-[5-[3,5-bis(bromanyl)-2-methoxy-phenyl]-1-ethyl-pyrrol-2-yl]azepane Openeye Name: 1-[5-(3,5-dibromo-2-methoxy-phenyl)-1-ethyl-pyrrol-2-yl]azepane CAS Name: 1-[5-(3,5-dibromo-2-methoxyphenyl)-1-ethyl-2-pyrrolyl]azepane IUPAC Name: 1-[5-(3,5-dibromo-2-methoxyphenyl)-1-ethylpyrrol-2-yl]azepane Traditional Name: 1-[5-(3,5-dibromo-2-methoxy-phenyl)-1-ethyl-pyrrol-2-yl]azepane Formula: C19H24Br2N2O MolecularWeight: 456.21466

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=C1N2CCCCCC2)C3=CC(=CC(=C3OC)Br)Br

Isomeric SMILES

CCN1C(=CC=C1N2CCCCCC2)C3=CC(=CC(=C3OC)Br)Br

InChI

InChI=1S/C19H24Br2N2O/c1-3-23-17(15-12-14(20)13-16(21)19(15)24-2)8-9-18(23)22-10-6-4-5-7-11-22/h8-9,12-13H,3-7,10-11H2,1-2H3