1-nitro-N-[3-(1-oxidanidylpiperidin-1-ium-1-yl)propyl]acridin-9-amine hydrochloride

Systemtic Name: 1-nitro-N-[3-(1-oxidanidylpiperidin-1-ium-1-yl)propyl]acridin-9-amine hydrochloride Openeye Name: 1-nitro-N-[3-(1-oxidopiperidin-1-ium-1-yl)propyl]acridin-9-amine hydrochloride CAS Name: 1-nitro-N-[3-(1-oxido-1-piperidin-1-iumyl)propyl]-9-acridinamine hydrochloride IUPAC Name: 1-nitro-N-[3-(1-oxidopiperidin-1-ium-1-yl)propyl]acridin-9-amine hydrochloride Traditional Name: (1-nitroacridin-9-yl)-[3-(1-oxidopiperidin-1-ium-1-yl)propyl]amine hydrochloride Formula: C21H25ClN4O3 MolecularWeight: 416.9012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](CC1)(CCCNC2=C3C(=NC4=CC=CC=C42)C=CC=C3[N+](=O)[O-])[O-].Cl

Isomeric SMILES

C1CC[N+](CC1)(CCCNC2=C3C(=NC4=CC=CC=C42)C=CC=C3[N+](=O)[O-])[O-].Cl

InChI

InChI=1S/C21H24N4O3.ClH/c26-24(27)19-11-6-10-18-20(19)21(16-8-2-3-9-17(16)23-18)22-12-7-15-25(28)13-4-1-5-14-25;/h2-3,6,8-11H,1,4-5,7,12-15H2,(H,22,23);1H