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

Systemtic Name: (4-chloranyl-1-methyl-2-phenyl-indol-3-yl)-[4-(5-nitropyridin-2-yl)-1,4-diazepan-1-yl]methanone Openeye Name: (4-chloro-1-methyl-2-phenyl-indol-3-yl)-[4-(5-nitro-2-pyridyl)-1,4-diazepan-1-yl]methanone CAS Name: (4-chloro-1-methyl-2-phenyl-3-indolyl)-[4-(5-nitro-2-pyridinyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (4-chloro-1-methyl-2-phenylindol-3-yl)-[4-(5-nitropyridin-2-yl)-1,4-diazepan-1-yl]methanone Traditional Name: (4-chloro-1-methyl-2-phenyl-indol-3-yl)-[4-(5-nitro-2-pyridyl)-1,4-diazepan-1-yl]methanone Formula: C26H24ClN5O3 MolecularWeight: 489.95346

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H24ClN5O3/c1-29-21-10-5-9-20(27)23(21)24(25(29)18-7-3-2-4-8-18)26(33)31-14-6-13-30(15-16-31)22-12-11-19(17-28-22)32(34)35/h2-5,7-12,17H,6,13-16H2,1H3