(3-iodanyl-5-nitro-phenyl)-[1-[(1-methylpiperidin-2-yl)methyl]indol-3-yl]methanone

Systemtic Name: (3-iodanyl-5-nitro-phenyl)-[1-[(1-methylpiperidin-2-yl)methyl]indol-3-yl]methanone Openeye Name: (3-iodo-5-nitro-phenyl)-[1-[(1-methyl-2-piperidyl)methyl]indol-3-yl]methanone CAS Name: (3-iodo-5-nitrophenyl)-[1-[(1-methyl-2-piperidinyl)methyl]-3-indolyl]methanone IUPAC Name: (3-iodo-5-nitrophenyl)-[1-[(1-methylpiperidin-2-yl)methyl]indol-3-yl]methanone Traditional Name: (3-iodo-5-nitro-phenyl)-[1-[(1-methyl-2-piperidyl)methyl]indol-3-yl]methanone Formula: C22H22IN3O3 MolecularWeight: 503.33285

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCCC1CN2C=C(C3=CC=CC=C32)C(=O)C4=CC(=CC(=C4)I)[N+](=O)[O-]

Isomeric SMILES

CN1CCCCC1CN2C=C(C3=CC=CC=C32)C(=O)C4=CC(=CC(=C4)I)[N+](=O)[O-]

InChI

InChI=1S/C22H22IN3O3/c1-24-9-5-4-6-17(24)13-25-14-20(19-7-2-3-8-21(19)25)22(27)15-10-16(23)12-18(11-15)26(28)29/h2-3,7-8,10-12,14,17H,4-6,9,13H2,1H3