7-chloranyl-N-(2-ethylpentyl)-5-nitro-1,2,3,4-tetrahydroxanthen-4a-amine

Systemtic Name: 7-chloranyl-N-(2-ethylpentyl)-5-nitro-1,2,3,4-tetrahydroxanthen-4a-amine Openeye Name: 7-chloro-N-(2-ethylpentyl)-5-nitro-1,2,3,4-tetrahydroxanthen-4a-amine CAS Name: 7-chloro-N-(2-ethylpentyl)-5-nitro-1,2,3,4-tetrahydroxanthen-4a-amine IUPAC Name: 7-chloro-N-(2-ethylpentyl)-5-nitro-1,2,3,4-tetrahydroxanthen-4a-amine Traditional Name: (7-chloro-5-nitro-1,2,3,4-tetrahydroxanthen-4a-yl)-(2-ethylpentyl)amine Formula: C20H27ClN2O3 MolecularWeight: 378.89298

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC)CNC12CCCCC1=CC3=CC(=CC(=C3O2)[N+](=O)[O-])Cl

Isomeric SMILES

CCCC(CC)CNC12CCCCC1=CC3=CC(=CC(=C3O2)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H27ClN2O3/c1-3-7-14(4-2)13-22-20-9-6-5-8-16(20)10-15-11-17(21)12-18(23(24)25)19(15)26-20/h10-12,14,22H,3-9,13H2,1-2H3