6-(3-bromophenyl)-N-(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-methyl-pyridine-3-carboxamide

Systemtic Name: 6-(3-bromophenyl)-N-(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-methyl-pyridine-3-carboxamide Openeye Name: 6-(3-bromophenyl)-N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-methyl-pyridine-3-carboxamide CAS Name: 6-(3-bromophenyl)-N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-methyl-3-pyridinecarboxamide IUPAC Name: 6-(3-bromophenyl)-N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-methylpyridine-3-carboxamide Traditional Name: 6-(3-bromophenyl)-N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-methyl-nicotinamide Formula: C22H18BrClN2O3 MolecularWeight: 473.74692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)C2=CC(=CC=C2)Br)C(=O)NC3=CC4=C(C=C3Cl)OCCCO4

Isomeric SMILES

CC1=C(C=CC(=N1)C2=CC(=CC=C2)Br)C(=O)NC3=CC4=C(C=C3Cl)OCCCO4

InChI

InChI=1S/C22H18BrClN2O3/c1-13-16(6-7-18(25-13)14-4-2-5-15(23)10-14)22(27)26-19-12-21-20(11-17(19)24)28-8-3-9-29-21/h2,4-7,10-12H,3,8-9H2,1H3,(H,26,27)