3-bromanyl-6-methoxy-N-[1-methyl-4-(phenylmethyl)-1,4-diazepan-6-yl]-2-oxidanyl-benzamide

Systemtic Name: 3-bromanyl-6-methoxy-N-[1-methyl-4-(phenylmethyl)-1,4-diazepan-6-yl]-2-oxidanyl-benzamide Openeye Name: N-(1-benzyl-4-methyl-1,4-diazepan-6-yl)-3-bromo-2-hydroxy-6-methoxy-benzamide CAS Name: 3-bromo-2-hydroxy-6-methoxy-N-[1-methyl-4-(phenylmethyl)-1,4-diazepan-6-yl]benzamide IUPAC Name: N-(1-benzyl-4-methyl-1,4-diazepan-6-yl)-3-bromo-2-hydroxy-6-methoxybenzamide Traditional Name: N-(1-benzyl-4-methyl-1,4-diazepan-6-yl)-3-bromo-2-hydroxy-6-methoxy-benzamide Formula: C21H26BrN3O3 MolecularWeight: 448.35344

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC(C1)NC(=O)C2=C(C=CC(=C2O)Br)OC)CC3=CC=CC=C3

Isomeric SMILES

CN1CCN(CC(C1)NC(=O)C2=C(C=CC(=C2O)Br)OC)CC3=CC=CC=C3

InChI

InChI=1S/C21H26BrN3O3/c1-24-10-11-25(12-15-6-4-3-5-7-15)14-16(13-24)23-21(27)19-18(28-2)9-8-17(22)20(19)26/h3-9,16,26H,10-14H2,1-2H3,(H,23,27)