(5-bromanylfuran-2-yl)-[4-(phenylmethyl)-1,4-diazepan-1-yl]methanone

Systemtic Name: (5-bromanylfuran-2-yl)-[4-(phenylmethyl)-1,4-diazepan-1-yl]methanone Openeye Name: (4-benzyl-1,4-diazepan-1-yl)-(5-bromo-2-furyl)methanone CAS Name: (5-bromo-2-furanyl)-[4-(phenylmethyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (4-benzyl-1,4-diazepan-1-yl)-(5-bromofuran-2-yl)methanone Traditional Name: (4-benzyl-1,4-diazepan-1-yl)-(5-bromo-2-furyl)methanone Formula: C17H19BrN2O2 MolecularWeight: 363.24896

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=CC=C(O2)Br)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=CC=C(O2)Br)CC3=CC=CC=C3

InChI

InChI=1S/C17H19BrN2O2/c18-16-8-7-15(22-16)17(21)20-10-4-9-19(11-12-20)13-14-5-2-1-3-6-14/h1-3,5-8H,4,9-13H2