(2-bromanyl-3-methyl-phenyl)-[4-(furan-2-ylmethyl)-1,4-diazepan-1-yl]methanone

Systemtic Name: (2-bromanyl-3-methyl-phenyl)-[4-(furan-2-ylmethyl)-1,4-diazepan-1-yl]methanone Openeye Name: (2-bromo-3-methyl-phenyl)-[4-(2-furylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: (2-bromo-3-methylphenyl)-[4-(2-furanylmethyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (2-bromo-3-methylphenyl)-[4-(furan-2-ylmethyl)-1,4-diazepan-1-yl]methanone Traditional Name: (2-bromo-3-methyl-phenyl)-[4-(2-furfuryl)-1,4-diazepan-1-yl]methanone Formula: C18H21BrN2O2 MolecularWeight: 377.27554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1Br)C(=O)N2CCCN(CC2)CC3=CC=CO3

Isomeric SMILES

CC1=CC=CC(=C1Br)C(=O)N2CCCN(CC2)CC3=CC=CO3

InChI

InChI=1S/C18H21BrN2O2/c1-14-5-2-7-16(17(14)19)18(22)21-9-4-8-20(10-11-21)13-15-6-3-12-23-15/h2-3,5-7,12H,4,8-11,13H2,1H3