N1-(3-methylbutyl)-N1'-(1-nitroacridin-9-yl)propane-1,1-diamine

Systemtic Name: N1-(3-methylbutyl)-N1'-(1-nitroacridin-9-yl)propane-1,1-diamine Openeye Name: N1-isopentyl-N1'-(1-nitroacridin-9-yl)propane-1,1-diamine CAS Name: N1-(3-methylbutyl)-N1'-(1-nitro-9-acridinyl)propane-1,1-diamine IUPAC Name: 1-N-(3-methylbutyl)-1-N'-(1-nitroacridin-9-yl)propane-1,1-diamine Traditional Name: isoamyl-[1-[(1-nitroacridin-9-yl)amino]propyl]amine Formula: C21H26N4O2 MolecularWeight: 366.45674

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Descriptors Computed from Structure

Canonical SMILES:

CCC(NCCC(C)C)NC1=C2C(=NC3=CC=CC=C31)C=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCC(NCCC(C)C)NC1=C2C(=NC3=CC=CC=C31)C=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C21H26N4O2/c1-4-19(22-13-12-14(2)3)24-21-15-8-5-6-9-16(15)23-17-10-7-11-18(20(17)21)25(26)27/h5-11,14,19,22H,4,12-13H2,1-3H3,(H,23,24)