6-nitro-2-octan-3-yl-2,3-dihydroindole-1-carboxamide hydrochloride

Systemtic Name: 6-nitro-2-octan-3-yl-2,3-dihydroindole-1-carboxamide hydrochloride Openeye Name: 2-(1-ethylhexyl)-6-nitro-indoline-1-carboxamide hydrochloride CAS Name: 6-nitro-2-octan-3-yl-2,3-dihydroindole-1-carboxamide hydrochloride IUPAC Name: 6-nitro-2-octan-3-yl-2,3-dihydroindole-1-carboxamide hydrochloride Traditional Name: 2-(1-ethylhexyl)-6-nitro-indoline-1-carboxamide hydrochloride Formula: C17H26ClN3O3 MolecularWeight: 355.85964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)C1CC2=C(N1C(=O)N)C=C(C=C2)[N+](=O)[O-].Cl

Isomeric SMILES

CCCCCC(CC)C1CC2=C(N1C(=O)N)C=C(C=C2)[N+](=O)[O-].Cl

InChI

InChI=1S/C17H25N3O3.ClH/c1-3-5-6-7-12(4-2)15-10-13-8-9-14(20(22)23)11-16(13)19(15)17(18)21;/h8-9,11-12,15H,3-7,10H2,1-2H3,(H2,18,21);1H