1-(1H-indol-3-yl)-7-(2-nitroethyl)azepan-2-imine

Systemtic Name: 1-(1H-indol-3-yl)-7-(2-nitroethyl)azepan-2-imine Openeye Name: 1-(1H-indol-3-yl)-7-(2-nitroethyl)azepan-2-imine CAS Name: 1-(1H-indol-3-yl)-7-(2-nitroethyl)-2-azepanimine IUPAC Name: 1-(1H-indol-3-yl)-7-(2-nitroethyl)azepan-2-imine Traditional Name: [1-(1H-indol-3-yl)-7-(2-nitroethyl)azepan-2-ylidene]amine Formula: C16H20N4O2 MolecularWeight: 300.3556

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=N)N(C(C1)CC[N+](=O)[O-])C2=CNC3=CC=CC=C32

Isomeric SMILES

C1CCC(=N)N(C(C1)CC[N+](=O)[O-])C2=CNC3=CC=CC=C32

InChI

InChI=1S/C16H20N4O2/c17-16-8-4-1-5-12(9-10-19(21)22)20(16)15-11-18-14-7-3-2-6-13(14)15/h2-3,6-7,11-12,17-18H,1,4-5,8-10H2