(5-bromanyl-1-methyl-2-phenyl-indol-3-yl)-[4-(5-nitropyridin-2-yl)-1,4-diazepan-1-yl]methanone

Systemtic Name: (5-bromanyl-1-methyl-2-phenyl-indol-3-yl)-[4-(5-nitropyridin-2-yl)-1,4-diazepan-1-yl]methanone Openeye Name: (5-bromo-1-methyl-2-phenyl-indol-3-yl)-[4-(5-nitro-2-pyridyl)-1,4-diazepan-1-yl]methanone CAS Name: (5-bromo-1-methyl-2-phenyl-3-indolyl)-[4-(5-nitro-2-pyridinyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (5-bromo-1-methyl-2-phenylindol-3-yl)-[4-(5-nitropyridin-2-yl)-1,4-diazepan-1-yl]methanone Traditional Name: (5-bromo-1-methyl-2-phenyl-indol-3-yl)-[4-(5-nitro-2-pyridyl)-1,4-diazepan-1-yl]methanone Formula: C26H24BrN5O3 MolecularWeight: 534.40446

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)Br)C(=C1C3=CC=CC=C3)C(=O)N4CCCN(CC4)C5=NC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CN1C2=C(C=C(C=C2)Br)C(=C1C3=CC=CC=C3)C(=O)N4CCCN(CC4)C5=NC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C26H24BrN5O3/c1-29-22-10-8-19(27)16-21(22)24(25(29)18-6-3-2-4-7-18)26(33)31-13-5-12-30(14-15-31)23-11-9-20(17-28-23)32(34)35/h2-4,6-11,16-17H,5,12-15H2,1H3