N-(2-butoxypropyl)-4-methyl-1-nitro-acridin-9-amine hydrochloride

Systemtic Name: N-(2-butoxypropyl)-4-methyl-1-nitro-acridin-9-amine hydrochloride Openeye Name: N-(2-butoxypropyl)-4-methyl-1-nitro-acridin-9-amine hydrochloride CAS Name: N-(2-butoxypropyl)-4-methyl-1-nitro-9-acridinamine hydrochloride IUPAC Name: N-(2-butoxypropyl)-4-methyl-1-nitroacridin-9-amine hydrochloride Traditional Name: 2-butoxypropyl-(4-methyl-1-nitro-acridin-9-yl)amine hydrochloride Formula: C21H26ClN3O3 MolecularWeight: 403.90244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(C)CNC1=C2C(=CC=C(C2=NC3=CC=CC=C31)C)[N+](=O)[O-].Cl

Isomeric SMILES

CCCCOC(C)CNC1=C2C(=CC=C(C2=NC3=CC=CC=C31)C)[N+](=O)[O-].Cl

InChI

InChI=1S/C21H25N3O3.ClH/c1-4-5-12-27-15(3)13-22-21-16-8-6-7-9-17(16)23-20-14(2)10-11-18(19(20)21)24(25)26;/h6-11,15H,4-5,12-13H2,1-3H3,(H,22,23);1H